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

Systemtic Name: 2-[4-(1,3-diethyl-2-oxidanylidene-benzimidazol-5-yl)-3-(3-methylphenyl)-1,3-dihydropyrazol-2-yl]ethanoic acid Openeye Name: 2-[4-(1,3-diethyl-2-oxo-benzimidazol-5-yl)-3-(m-tolyl)-1,3-dihydropyrazol-2-yl]acetic acid CAS Name: 2-[4-(1,3-diethyl-2-oxo-5-benzimidazolyl)-3-(3-methylphenyl)-1,3-dihydropyrazol-2-yl]acetic acid IUPAC Name: 2-[4-(1,3-diethyl-2-oxobenzimidazol-5-yl)-3-(3-methylphenyl)-1,3-dihydropyrazol-2-yl]acetic acid Traditional Name: 2-[4-(1,3-diethyl-2-keto-benzimidazol-5-yl)-5-(m-tolyl)-3-pyrazolin-1-yl]acetic acid Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C3=CNN(C3C4=CC(=CC=C4)C)CC(=O)O)N(C1=O)CC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C3=CNN(C3C4=CC(=CC=C4)C)CC(=O)O)N(C1=O)CC

InChI

InChI=1S/C23H26N4O3/c1-4-25-19-10-9-16(12-20(19)26(5-2)23(25)30)18-13-24-27(14-21(28)29)22(18)17-8-6-7-15(3)11-17/h6-13,22,24H,4-5,14H2,1-3H3,(H,28,29)