3-methyl-2-(2-phenylethanoylamino)butanoate

Systemtic Name: 3-methyl-2-(2-phenylethanoylamino)butanoate Openeye Name: 3-methyl-2-[(2-phenylacetyl)amino]butanoate CAS Name: 3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanoate IUPAC Name: 3-methyl-2-[(2-phenylacetyl)amino]butanoate Traditional Name: 3-methyl-2-[(2-phenylacetyl)amino]butyrate Formula: C13H16NO3- MolecularWeight: 234.27104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC(=O)CC1=CC=CC=C1

Isomeric SMILES

CC(C)C(C(=O)[O-])NC(=O)CC1=CC=CC=C1

InChI

InChI=1S/C13H17NO3/c1-9(2)12(13(16)17)14-11(15)8-10-6-4-3-5-7-10/h3-7,9,12H,8H2,1-2H3,(H,14,15)(H,16,17)/p-1