Chem
J-GLOBAL ID:200907051645309050
Nikkaji number:J1.716.688C
2-Oxo-3-propyl-9cβ-phenyl-2,3,4,9c-tetrahydro-3-aza-2aH-pentaleno[1,6-ab]naphthalene-1,2aβ-dicarboxylic acid dimethyl ester
2-オキソ-3-プロピル-9cβ-フェニル-2,3,4,9c-テトラヒドロ-3-アザ-2aH-ペンタレノ[1,6-ab]ナフタレン-1,2aβ-ジカルボン酸ジメチル
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Substance type:
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
Molecular formula:
C27 H25 NO5
Molecular formula furigana:
C27-H25-N-O5
Molecular weight:
443.499
InChI:
InChI=1S/C27H25NO5/c1-4-14-28-16-19-15-17-10-8-9-13-20(17)22-21(24(30)32-2)23(29)27(28,25(31)33-3)26(19,22)18-11-6-5-7-12-18/h5-13,15H,4,14,16H2,1-3H3/t26-,27-/m1/s1
InChI key:
DFODFHAVJYGBKX-KAYWLYCHSA-N
SMILES:
CCCN1CC2=Cc3ccccc3C3=C(C(=O)OC)C(=O)[C@@]1(C(=O)OC)[C@]23c1ccccc1
Systematic name (3):
2-オキソ-3-プロピル-9cβ-フェニル-2,3,4,9c-テトラヒドロ-3-アザ-2aH-ペンタレノ[1,6-ab]ナフタレン-1,2aβ-ジカルボン酸ジメチル
12,14-ジメチル (12R,15S)-13-オキソ-15-フェニル-11-プロピル-11-アザテトラシクロ[7.5.1.02,7 .012,15 ]ペンタデカ-1(14),2,4,6,8-ペンタエン-12,14-ジカルボキシラート
12,14-dimethyl (12R,15S)-13-oxo-15-phenyl-11-propyl-11-azatetracyclo[7.5.1.02,7 .012,15 ]pentadeca-1(14),2,4,6,8-pentaene-12,14-dicarboxylate
Other name (1):
2-Oxo-3-propyl-9cβ-phenyl-2,3,4,9c-tetrahydro-3-aza-2aH-pentaleno[1,6-ab]naphthalene-1,2aβ-dicarboxylic acid dimethyl ester
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