3-[(2,4-dimethylphenyl)carbonylamino]propanoate

Systemtic Name: 3-[(2,4-dimethylphenyl)carbonylamino]propanoate Openeye Name: 3-[(2,4-dimethylbenzoyl)amino]propanoate CAS Name: 3-[[(2,4-dimethylphenyl)-oxomethyl]amino]propanoate IUPAC Name: 3-[(2,4-dimethylbenzoyl)amino]propanoate Traditional Name: 3-[(2,4-dimethylbenzoyl)amino]propionate Formula: C12H14NO3- MolecularWeight: 220.24446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO3/c1-8-3-4-10(9(2)7-8)12(16)13-6-5-11(14)15/h3-4,7H,5-6H2,1-2H3,(H,13,16)(H,14,15)/p-1