4-[3-(5,6-dimethylbenzimidazol-2-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]benzoic acid

Systemtic Name: 4-[3-(5,6-dimethylbenzimidazol-2-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]benzoic acid Openeye Name: 4-[3-(5,6-dimethylbenzimidazol-2-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]benzoic acid CAS Name: 4-[3-(5,6-dimethyl-2-benzimidazolylidene)-5-methyl-1,2-dihydropyrazol-4-yl]benzoic acid IUPAC Name: 4-[3-(5,6-dimethylbenzimidazol-2-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]benzoic acid Traditional Name: 4-[3-(5,6-dimethylbenzimidazol-2-ylidene)-5-methyl-3-pyrazolin-4-yl]benzoic acid Formula: C20H18N4O2 MolecularWeight: 346.38252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C3C(=C(NN3)C)C4=CC=C(C=C4)C(=O)O)N=C2C=C1C

Isomeric SMILES

CC1=CC2=NC(=C3C(=C(NN3)C)C4=CC=C(C=C4)C(=O)O)N=C2C=C1C

InChI

InChI=1S/C20H18N4O2/c1-10-8-15-16(9-11(10)2)22-19(21-15)18-17(12(3)23-24-18)13-4-6-14(7-5-13)20(25)26/h4-9,23-24H,1-3H3,(H,25,26)