4-[(4,6-dimethylpyrimidin-2-yl)carbamoyl]benzoic acid

Systemtic Name: 4-[(4,6-dimethylpyrimidin-2-yl)carbamoyl]benzoic acid Openeye Name: 4-[(4,6-dimethylpyrimidin-2-yl)carbamoyl]benzoic acid CAS Name: 4-[[(4,6-dimethyl-2-pyrimidinyl)amino]-oxomethyl]benzoic acid IUPAC Name: 4-[(4,6-dimethylpyrimidin-2-yl)carbamoyl]benzoic acid Traditional Name: 4-[(4,6-dimethylpyrimidin-2-yl)carbamoyl]benzoic acid Formula: C14H13N3O3 MolecularWeight: 271.27132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)C2=CC=C(C=C2)C(=O)O)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)C2=CC=C(C=C2)C(=O)O)C

InChI

InChI=1S/C14H13N3O3/c1-8-7-9(2)16-14(15-8)17-12(18)10-3-5-11(6-4-10)13(19)20/h3-7H,1-2H3,(H,19,20)(H,15,16,17,18)