propyl (6S)-6-(2,5-dimethoxyphenyl)-3-methyl-4-oxidanylidene-1,5,6,7-tetrahydroindole-2-carboxylate

Systemtic Name: propyl (6S)-6-(2,5-dimethoxyphenyl)-3-methyl-4-oxidanylidene-1,5,6,7-tetrahydroindole-2-carboxylate Openeye Name: propyl (6S)-6-(2,5-dimethoxyphenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate CAS Name: (6S)-6-(2,5-dimethoxyphenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylic acid propyl ester IUPAC Name: propyl (6S)-6-(2,5-dimethoxyphenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate Traditional Name: (6S)-6-(2,5-dimethoxyphenyl)-4-keto-3-methyl-1,5,6,7-tetrahydroindole-2-carboxylic acid propyl ester Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(C2=C(N1)CC(CC2=O)C3=C(C=CC(=C3)OC)OC)C

Isomeric SMILES

CCCOC(=O)C1=C(C2=C(N1)C[C@@H](CC2=O)C3=C(C=CC(=C3)OC)OC)C

InChI

InChI=1S/C21H25NO5/c1-5-8-27-21(24)20-12(2)19-16(22-20)9-13(10-17(19)23)15-11-14(25-3)6-7-18(15)26-4/h6-7,11,13,22H,5,8-10H2,1-4H3/t13-/m0/s1