Chem
J-GLOBAL ID：200907003487519129
Nikkaji number：J2.398.201C
(1′S,3′R)-1′β-(4-Methylphenyl)-5′,6′,7′,7a′β-tetrahydrodispiro[indan-2,2′(3′H)-[1H]pyrrolizine-3′,11′′-[11H]indeno[1,2-b]quinoxaline]-1,3-dione
(1'S,3'R,7'aR)-1'-(4-メチルフェニル)-1,3,5',6',7',7'a-ヘキサヒドロ-1'H-ジスピロ[インデン-2,2'-ピロリジン-3',11''-インデノ[1,2-b]キノキサリン]-1,3-ジオン
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C36H27N3O2
Molecular formula furigana： C36-H27-N3-O2
Molecular weight： 533.631
InChI：
InChI=1S/C36H27N3O2/c1-21-16-18-22(19-17-21)30-29-15-8-20-39(29)36(35(30)33(40)23-9-2-3-10-24(23)34(35)41)26-12-5-4-11-25(26)31-32(36)38-28-14-7-6-13-27(28)37-31/h2-7,9-14,16-19,29-30H,8,15,20H2,1H3/t29-,30-,36+/m1/s1
InChI key：
JTGNIDPLWFTQPT-RQZQZYMYSA-N
SMILES：
Cc1ccc(cc1)[C@@H]1[C@H]2CCCN2[C@]2(c3ccccc3c3nc4ccccc4nc23)C21C(=O)c1ccccc1C2=O
Systematic name (3)：
- (1′S,3′R)-1′β-(4-メチルフェニル)-5′,6′,7′,7a′β-テトラヒドロジスピロ[インダン-2,2′(3′H)-[1H]ピロリザイン-3′,11′′-[11H]インデノ[1,2-b]キノキサリン]-1,3-ジオン
- (1'S,3'R,7'aR)-1'-(4-メチルフェニル)-1,3,5',6',7',7'a-ヘキサヒドロ-1'H-ジスピロ[インデン-2,2'-ピロリジン-3',11''-インデノ[1,2-b]キノキサリン]-1,3-ジオン
- (1'S,3'R,7'aR)-1'-(4-methylphenyl)-1,3,5',6',7',7'a-hexahydro-1'H-dispiro[indene-2,2'-pyrrolizine-3',11''-indeno[1,2-b]quinoxaline]-1,3-dione
- (1′S,3′R)-1′β-(4-Methylphenyl)-5′,6′,7′,7a′β-tetrahydrodispiro[indan-2,2′(3′H)-[1H]pyrrolizine-3′,11′′-[11H]indeno[1,2-b]quinoxaline]-1,3-dione
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