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

Systemtic Name: 2-[[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]carbamoyl]benzoic acid Openeye Name: 2-[[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]carbamoyl]benzoic acid CAS Name: 2-[[4-[(4,6-dimethyl-2-pyrimidinyl)oxy]anilino]-oxomethyl]benzoic acid IUPAC Name: 2-[[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]carbamoyl]benzoic acid Traditional Name: 2-[[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]carbamoyl]benzoic acid Formula: C20H17N3O4 MolecularWeight: 363.36668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)OC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C(=O)O)C

Isomeric SMILES

CC1=CC(=NC(=N1)OC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C(=O)O)C

InChI

InChI=1S/C20H17N3O4/c1-12-11-13(2)22-20(21-12)27-15-9-7-14(8-10-15)23-18(24)16-5-3-4-6-17(16)19(25)26/h3-11H,1-2H3,(H,23,24)(H,25,26)