3-[2-methylpropanoyl(phenyl)amino]propanoic acid

Systemtic Name: 3-[2-methylpropanoyl(phenyl)amino]propanoic acid Openeye Name: 3-[N-(2-methylpropanoyl)anilino]propanoic acid CAS Name: 3-(N-(2-methyl-1-oxopropyl)anilino)propanoic acid IUPAC Name: 3-[N-(2-methylpropanoyl)anilino]propanoic acid Traditional Name: 3-(N-isobutyrylanilino)propionic acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N(CCC(=O)O)C1=CC=CC=C1

Isomeric SMILES

CC(C)C(=O)N(CCC(=O)O)C1=CC=CC=C1

InChI

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