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

Systemtic Name: [(2S)-1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-methylpropanoate Openeye Name: [(1S)-1-methyl-2-(4-methylanilino)-2-oxo-ethyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [(2S)-1-(4-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-methylanilino)-1-oxopropan-2-yl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [(1S)-2-keto-1-methyl-2-(p-toluidino)ethyl] ester Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO3/c1-9(2)14(17)18-11(4)13(16)15-12-7-5-10(3)6-8-12/h5-9,11H,1-4H3,(H,15,16)/t11-/m0/s1