1-cyclohexyl-2-[3-[[phenyl-(phenylmethyl)amino]methyl]phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[3-[[phenyl-(phenylmethyl)amino]methyl]phenyl]benzimidazole-5-carboxylic acid Openeye Name: 2-[3-[(N-benzylanilino)methyl]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[3-[(N-(phenylmethyl)anilino)methyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 2-[3-[(N-benzylanilino)methyl]phenyl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[3-[(N-benzylanilino)methyl]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C34H33N3O2 MolecularWeight: 515.64472

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC(=CC=C4)CN(CC5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC(=CC=C4)CN(CC5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H33N3O2/c38-34(39)28-19-20-32-31(22-28)35-33(37(32)30-17-8-3-9-18-30)27-14-10-13-26(21-27)24-36(29-15-6-2-7-16-29)23-25-11-4-1-5-12-25/h1-2,4-7,10-16,19-22,30H,3,8-9,17-18,23-24H2,(H,38,39)