[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 2-phenylbutanoate

Systemtic Name: [2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 2-phenylbutanoate Openeye Name: [2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl] 2-phenylbutanoate CAS Name: 2-phenylbutanoic acid [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] 2-phenylbutanoate Traditional Name: 2-phenylbutyric acid [2-keto-2-(2-methyl-1H-indol-3-yl)ethyl] ester Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)OCC(=O)C2=C(NC3=CC=CC=C32)C

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)OCC(=O)C2=C(NC3=CC=CC=C32)C

InChI

InChI=1S/C21H21NO3/c1-3-16(15-9-5-4-6-10-15)21(24)25-13-19(23)20-14(2)22-18-12-8-7-11-17(18)20/h4-12,16,22H,3,13H2,1-2H3