2-[(3-methylphenyl)carbonylamino]terephthalic acid

Systemtic Name: 2-[(3-methylphenyl)carbonylamino]terephthalic acid Openeye Name: 2-[(3-methylbenzoyl)amino]terephthalic acid CAS Name: 2-[[(3-methylphenyl)-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[(3-methylbenzoyl)amino]terephthalic acid Traditional Name: 2-(m-toluoylamino)terephthalic acid Formula: C16H13NO5 MolecularWeight: 299.27812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C16H13NO5/c1-9-3-2-4-10(7-9)14(18)17-13-8-11(15(19)20)5-6-12(13)16(21)22/h2-8H,1H3,(H,17,18)(H,19,20)(H,21,22)