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

Systemtic Name: phenethyl (6R)-6-(3,4-dimethoxyphenyl)-3-methyl-4-oxidanylidene-1,5,6,7-tetrahydroindole-2-carboxylate Openeye Name: phenethyl (6R)-6-(3,4-dimethoxyphenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate CAS Name: (6R)-6-(3,4-dimethoxyphenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylic acid phenethyl ester IUPAC Name: phenethyl (6R)-6-(3,4-dimethoxyphenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate Traditional Name: (6R)-6-(3,4-dimethoxyphenyl)-4-keto-3-methyl-1,5,6,7-tetrahydroindole-2-carboxylic acid phenethyl ester Formula: C26H27NO5 MolecularWeight: 433.49628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C(=O)CC(C2)C3=CC(=C(C=C3)OC)OC)C(=O)OCCC4=CC=CC=C4

Isomeric SMILES

CC1=C(NC2=C1C(=O)C[C@@H](C2)C3=CC(=C(C=C3)OC)OC)C(=O)OCCC4=CC=CC=C4

InChI

InChI=1S/C26H27NO5/c1-16-24-20(27-25(16)26(29)32-12-11-17-7-5-4-6-8-17)13-19(14-21(24)28)18-9-10-22(30-2)23(15-18)31-3/h4-10,15,19,27H,11-14H2,1-3H3/t19-/m1/s1