2-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]benzoic acid

Systemtic Name: 2-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]benzoic acid Openeye Name: 2-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]benzoic acid CAS Name: 2-[[(3,5-dimethyl-1,2,4-triazol-4-yl)amino]-oxomethyl]benzoic acid IUPAC Name: 2-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]benzoic acid Traditional Name: 2-[(3,5-dimethyl-1,2,4-triazol-4-yl)carbamoyl]benzoic acid Formula: C12H12N4O3 MolecularWeight: 260.24868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1NC(=O)C2=CC=CC=C2C(=O)O)C

Isomeric SMILES

CC1=NN=C(N1NC(=O)C2=CC=CC=C2C(=O)O)C

InChI

InChI=1S/C12H12N4O3/c1-7-13-14-8(2)16(7)15-11(17)9-5-3-4-6-10(9)12(18)19/h3-6H,1-2H3,(H,15,17)(H,18,19)