[(1R)-2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] pentanoate

Systemtic Name: [(1R)-2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] pentanoate Openeye Name: [(1R)-2-(1H-indol-3-yl)-2-oxo-1-phenyl-ethyl] pentanoate CAS Name: pentanoic acid [(1R)-2-(1H-indol-3-yl)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(1H-indol-3-yl)-2-oxo-1-phenylethyl] pentanoate Traditional Name: valeric acid [(1R)-2-(1H-indol-3-yl)-2-keto-1-phenyl-ethyl] ester Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCC(=O)O[C@H](C1=CC=CC=C1)C(=O)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C21H21NO3/c1-2-3-13-19(23)25-21(15-9-5-4-6-10-15)20(24)17-14-22-18-12-8-7-11-16(17)18/h4-12,14,21-22H,2-3,13H2,1H3/t21-/m1/s1