[(2R)-1-(2-methyl-1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] pentanoate

Systemtic Name: [(2R)-1-(2-methyl-1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] pentanoate Openeye Name: [(1R)-1-methyl-2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl] pentanoate CAS Name: pentanoic acid [(2R)-1-(2-methyl-1H-indol-3-yl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-methyl-1H-indol-3-yl)-1-oxopropan-2-yl] pentanoate Traditional Name: valeric acid [(1R)-2-keto-1-methyl-2-(2-methyl-1H-indol-3-yl)ethyl] ester Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC(C)C(=O)C1=C(NC2=CC=CC=C21)C

Isomeric SMILES

CCCCC(=O)O[C@H](C)C(=O)C1=C(NC2=CC=CC=C21)C

InChI

InChI=1S/C17H21NO3/c1-4-5-10-15(19)21-12(3)17(20)16-11(2)18-14-9-7-6-8-13(14)16/h6-9,12,18H,4-5,10H2,1-3H3/t12-/m1/s1