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

Systemtic Name: phenethyl (6R)-6-(4-methoxyphenyl)-3-methyl-4-oxidanylidene-1,5,6,7-tetrahydroindole-2-carboxylate Openeye Name: phenethyl (6R)-6-(4-methoxyphenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate CAS Name: (6R)-6-(4-methoxyphenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylic acid phenethyl ester IUPAC Name: phenethyl (6R)-6-(4-methoxyphenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate Traditional Name: (6R)-4-keto-6-(4-methoxyphenyl)-3-methyl-1,5,6,7-tetrahydroindole-2-carboxylic acid phenethyl ester Formula: C25H25NO4 MolecularWeight: 403.4703

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25NO4/c1-16-23-21(14-19(15-22(23)27)18-8-10-20(29-2)11-9-18)26-24(16)25(28)30-13-12-17-6-4-3-5-7-17/h3-11,19,26H,12-15H2,1-2H3/t19-/m1/s1