[2-(1-methyl-2-oxidanylidene-3H-indol-5-yl)-2-oxidanylidene-ethyl] (3R)-3-phenylbutanoate

Systemtic Name: [2-(1-methyl-2-oxidanylidene-3H-indol-5-yl)-2-oxidanylidene-ethyl] (3R)-3-phenylbutanoate Openeye Name: [2-(1-methyl-2-oxo-indolin-5-yl)-2-oxo-ethyl] (3R)-3-phenylbutanoate CAS Name: (3R)-3-phenylbutanoic acid [2-(1-methyl-2-oxo-3H-indol-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(1-methyl-2-oxo-3H-indol-5-yl)-2-oxoethyl] (3R)-3-phenylbutanoate Traditional Name: (3R)-3-phenylbutyric acid [2-keto-2-(2-keto-1-methyl-indolin-5-yl)ethyl] ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC(=O)C1=CC2=C(C=C1)N(C(=O)C2)C)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CC(=O)OCC(=O)C1=CC2=C(C=C1)N(C(=O)C2)C)C3=CC=CC=C3

InChI

InChI=1S/C21H21NO4/c1-14(15-6-4-3-5-7-15)10-21(25)26-13-19(23)16-8-9-18-17(11-16)12-20(24)22(18)2/h3-9,11,14H,10,12-13H2,1-2H3/t14-/m1/s1