4-[(3-methylphenyl)carbonylamino]butanoate

Systemtic Name: 4-[(3-methylphenyl)carbonylamino]butanoate Openeye Name: 4-[(3-methylbenzoyl)amino]butanoate CAS Name: 4-[[(3-methylphenyl)-oxomethyl]amino]butanoate IUPAC Name: 4-[(3-methylbenzoyl)amino]butanoate Traditional Name: 4-(m-toluoylamino)butyrate Formula: C12H14NO3- MolecularWeight: 220.24446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO3/c1-9-4-2-5-10(8-9)12(16)13-7-3-6-11(14)15/h2,4-5,8H,3,6-7H2,1H3,(H,13,16)(H,14,15)/p-1