(phenylmethyl) 3-methyl-5-oxidanylidene-1,4,6,7-tetrahydroindole-2-carboxylate

Systemtic Name: (phenylmethyl) 3-methyl-5-oxidanylidene-1,4,6,7-tetrahydroindole-2-carboxylate Openeye Name: benzyl 3-methyl-5-oxo-1,4,6,7-tetrahydroindole-2-carboxylate CAS Name: 3-methyl-5-oxo-1,4,6,7-tetrahydroindole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-methyl-5-oxo-1,4,6,7-tetrahydroindole-2-carboxylate Traditional Name: 5-keto-3-methyl-1,4,6,7-tetrahydroindole-2-carboxylic acid benzyl ester Formula: C17H17NO3 MolecularWeight: 283.32178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1CC(=O)CC2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(NC2=C1CC(=O)CC2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C17H17NO3/c1-11-14-9-13(19)7-8-15(14)18-16(11)17(20)21-10-12-5-3-2-4-6-12/h2-6,18H,7-10H2,1H3