3-[(3-methylphenyl)-(2-methylpropanoyl)amino]propanoate

Systemtic Name: 3-[(3-methylphenyl)-(2-methylpropanoyl)amino]propanoate Openeye Name: 3-[3-methyl-N-(2-methylpropanoyl)anilino]propanoate CAS Name: 3-(3-methyl-N-(2-methyl-1-oxopropyl)anilino)propanoate IUPAC Name: 3-[3-methyl-N-(2-methylpropanoyl)anilino]propanoate Traditional Name: 3-(N-isobutyryl-3-methyl-anilino)propionate Formula: C14H18NO3- MolecularWeight: 248.29762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CCC(=O)[O-])C(=O)C(C)C

Isomeric SMILES

CC1=CC(=CC=C1)N(CCC(=O)[O-])C(=O)C(C)C

InChI

InChI=1S/C14H19NO3/c1-10(2)14(18)15(8-7-13(16)17)12-6-4-5-11(3)9-12/h4-6,9-10H,7-8H2,1-3H3,(H,16,17)/p-1