Chem
J-GLOBAL ID：201507008990419239
Nikkaji number：J3.453.150A
(12S)-5′-Chloro-1′-methyl-7,11bα-dihydrospiro[13H-dibenzo[a,f]quinolizine-12(6H),3′(2′H)-[1H]indole]-2′-one
(12S)-5′-クロロ-1′-メチル-7,11bα-ジヒドロスピロ[13H-ジベンゾ[a,f]キノリジン-12(6H),3′(2′H)-[1H]インドール]-2′-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： C25H21ClN2O
Molecular formula furigana： C25-H21-CL-N2-O
Molecular weight： 400.910
InChI：
InChI=1S/C25H21ClN2O/c1-27-22-11-10-18(26)14-20(22)25(24(27)29)15-17-7-3-5-9-21(17)28-13-12-16-6-2-4-8-19(16)23(25)28/h2-11,14,23H,12-13,15H2,1H3/t23-,25-/m0/s1
InChI key：
FBHIOBJWZFMBGL-ZCYQVOJMSA-N
SMILES：
CN1C(=O)[C@@]2(Cc3ccccc3N3CCc4ccccc4[C@@H]23)c2cc(Cl)ccc12
Systematic name (3)：
- (12S)-5′-クロロ-1′-メチル-7,11bα-ジヒドロスピロ[13H-ジベンゾ[a,f]キノリジン-12(6H),3′(2′H)-[1H]インドール]-2′-オン
- (3S,11'bS)-5-クロロ-1-メチル-1,2,6',7',11'b,13'-ヘキサヒドロスピロ[インドール-3,12'-イソキノリノ[2,1-a]キノリン]-2-オン
- (3S,11'bS)-5-chloro-1-methyl-1,2,6',7',11'b,13'-hexahydrospiro[indole-3,12'-isoquinolino[2,1-a]quinolin]-2-one
- (12S)-5′-Chloro-1′-methyl-7,11bα-dihydrospiro[13H-dibenzo[a,f]quinolizine-12(6H),3′(2′H)-[1H]indole]-2′-one
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