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

Systemtic Name: [2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] 3,4-dimethylbenzoate Openeye Name: [2-(1H-indol-3-yl)-2-oxo-1-phenyl-ethyl] 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic acid [2-(1H-indol-3-yl)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(1H-indol-3-yl)-2-oxo-1-phenylethyl] 3,4-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid [2-(1H-indol-3-yl)-2-keto-1-phenyl-ethyl] ester Formula: C25H21NO3 MolecularWeight: 383.43914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43)C

InChI

InChI=1S/C25H21NO3/c1-16-12-13-19(14-17(16)2)25(28)29-24(18-8-4-3-5-9-18)23(27)21-15-26-22-11-7-6-10-20(21)22/h3-15,24,26H,1-2H3