2-(1-oxidanylidenepropan-2-ylamino)-4-phenyl-butanoic acid

Systemtic Name: 2-(1-oxidanylidenepropan-2-ylamino)-4-phenyl-butanoic acid Openeye Name: 2-[(1-methyl-2-oxo-ethyl)amino]-4-phenyl-butanoic acid CAS Name: 2-(1-oxopropan-2-ylamino)-4-phenylbutanoic acid IUPAC Name: 2-(1-oxopropan-2-ylamino)-4-phenylbutanoic acid Traditional Name: 2-[(2-keto-1-methyl-ethyl)amino]-4-phenyl-butyric acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=O)NC(CCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(C=O)NC(CCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C13H17NO3/c1-10(9-15)14-12(13(16)17)8-7-11-5-3-2-4-6-11/h2-6,9-10,12,14H,7-8H2,1H3,(H,16,17)