[(2S)-1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] cyclopentanecarboxylate

Systemtic Name: [(2S)-1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] cyclopentanecarboxylate Openeye Name: [(1S)-1-methyl-2-(4-methylanilino)-2-oxo-ethyl] cyclopentanecarboxylate CAS Name: cyclopentanecarboxylic acid [(2S)-1-(4-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-methylanilino)-1-oxopropan-2-yl] cyclopentanecarboxylate Traditional Name: cyclopentanecarboxylic acid [(1S)-2-keto-1-methyl-2-(p-toluidino)ethyl] ester Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C)OC(=O)C2CCCC2

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)[C@H](C)OC(=O)C2CCCC2

InChI

InChI=1S/C16H21NO3/c1-11-7-9-14(10-8-11)17-15(18)12(2)20-16(19)13-5-3-4-6-13/h7-10,12-13H,3-6H2,1-2H3,(H,17,18)/t12-/m0/s1