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

Systemtic Name: phenethyl (6R)-3-methyl-4-oxidanylidene-6-(3,4,5-trimethoxyphenyl)-1,5,6,7-tetrahydroindole-2-carboxylate Openeye Name: phenethyl (6R)-3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-1,5,6,7-tetrahydroindole-2-carboxylate CAS Name: (6R)-3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-1,5,6,7-tetrahydroindole-2-carboxylic acid phenethyl ester IUPAC Name: phenethyl (6R)-3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-1,5,6,7-tetrahydroindole-2-carboxylate Traditional Name: (6R)-4-keto-3-methyl-6-(3,4,5-trimethoxyphenyl)-1,5,6,7-tetrahydroindole-2-carboxylic acid phenethyl ester Formula: C27H29NO6 MolecularWeight: 463.52226

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C27H29NO6/c1-16-24-20(28-25(16)27(30)34-11-10-17-8-6-5-7-9-17)12-18(13-21(24)29)19-14-22(31-2)26(33-4)23(15-19)32-3/h5-9,14-15,18,28H,10-13H2,1-4H3/t18-/m1/s1