3-(4-chlorophenyl)-3-(2-methylpropanoylamino)propanoic acid

Systemtic Name: 3-(4-chlorophenyl)-3-(2-methylpropanoylamino)propanoic acid Openeye Name: 3-(4-chlorophenyl)-3-(2-methylpropanoylamino)propanoic acid CAS Name: 3-(4-chlorophenyl)-3-[(2-methyl-1-oxopropyl)amino]propanoic acid IUPAC Name: 3-(4-chlorophenyl)-3-(2-methylpropanoylamino)propanoic acid Traditional Name: 3-(4-chlorophenyl)-3-(isobutyrylamino)propionic acid Formula: C13H16ClNO3 MolecularWeight: 269.72404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClNO3/c1-8(2)13(18)15-11(7-12(16)17)9-3-5-10(14)6-4-9/h3-6,8,11H,7H2,1-2H3,(H,15,18)(H,16,17)