4-[(2,3-dimethylphenyl)carbonylamino]butanoic acid

Systemtic Name: 4-[(2,3-dimethylphenyl)carbonylamino]butanoic acid Openeye Name: 4-[(2,3-dimethylbenzoyl)amino]butanoic acid CAS Name: 4-[[(2,3-dimethylphenyl)-oxomethyl]amino]butanoic acid IUPAC Name: 4-[(2,3-dimethylbenzoyl)amino]butanoic acid Traditional Name: 4-[(2,3-dimethylbenzoyl)amino]butyric acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1C)C(=O)NCCCC(=O)O

Isomeric SMILES

CC1=CC=CC(=C1C)C(=O)NCCCC(=O)O

InChI

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