2-[4-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)-5-(3-methylphenyl)pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)-5-(3-methylphenyl)pyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-(1,3-dimethyl-2-oxo-benzimidazol-5-yl)-5-(m-tolyl)pyrazol-1-yl]acetic acid CAS Name: 2-[4-(1,3-dimethyl-2-oxo-5-benzimidazolyl)-5-(3-methylphenyl)-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-5-(3-methylphenyl)pyrazol-1-yl]acetic acid Traditional Name: 2-[4-(2-keto-1,3-dimethyl-benzimidazol-5-yl)-5-(m-tolyl)pyrazol-1-yl]acetic acid Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(C=NN2CC(=O)O)C3=CC4=C(C=C3)N(C(=O)N4C)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(C=NN2CC(=O)O)C3=CC4=C(C=C3)N(C(=O)N4C)C

InChI

InChI=1S/C21H20N4O3/c1-13-5-4-6-15(9-13)20-16(11-22-25(20)12-19(26)27)14-7-8-17-18(10-14)24(3)21(28)23(17)2/h4-11H,12H2,1-3H3,(H,26,27)