1-cyclohexyl-2-[4-(phenylazanylmethyl)phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[4-(phenylazanylmethyl)phenyl]benzimidazole-5-carboxylic acid Openeye Name: 2-[4-(anilinomethyl)phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[4-(anilinomethyl)phenyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[4-(anilinomethyl)phenyl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[4-(anilinomethyl)phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C27H27N3O2 MolecularWeight: 425.52218

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)CNC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)CNC5=CC=CC=C5

InChI

InChI=1S/C27H27N3O2/c31-27(32)21-15-16-25-24(17-21)29-26(30(25)23-9-5-2-6-10-23)20-13-11-19(12-14-20)18-28-22-7-3-1-4-8-22/h1,3-4,7-8,11-17,23,28H,2,5-6,9-10,18H2,(H,31,32)