2-(3-oxidanylidenebutan-2-ylamino)-4-phenyl-butanoic acid

Systemtic Name: 2-(3-oxidanylidenebutan-2-ylamino)-4-phenyl-butanoic acid Openeye Name: 2-[(1-methyl-2-oxo-propyl)amino]-4-phenyl-butanoic acid CAS Name: 2-(3-oxobutan-2-ylamino)-4-phenylbutanoic acid IUPAC Name: 2-(3-oxobutan-2-ylamino)-4-phenylbutanoic acid Traditional Name: 2-[(2-keto-1-methyl-propyl)amino]-4-phenyl-butyric acid Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO3/c1-10(11(2)16)15-13(14(17)18)9-8-12-6-4-3-5-7-12/h3-7,10,13,15H,8-9H2,1-2H3,(H,17,18)