[1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 3,4-dimethylbenzoate

Systemtic Name: [1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 3,4-dimethylbenzoate Openeye Name: [2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl] 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic acid [1-(1H-indol-3-yl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(1H-indol-3-yl)-1-oxopropan-2-yl] 3,4-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid [2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl] ester Formula: C20H19NO3 MolecularWeight: 321.36976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC(C)C(=O)C2=CNC3=CC=CC=C32)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC(C)C(=O)C2=CNC3=CC=CC=C32)C

InChI

InChI=1S/C20H19NO3/c1-12-8-9-15(10-13(12)2)20(23)24-14(3)19(22)17-11-21-18-7-5-4-6-16(17)18/h4-11,14,21H,1-3H3