1-cyclohexyl-2-[3-[(naphthalen-1-ylmethylamino)methyl]phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[3-[(naphthalen-1-ylmethylamino)methyl]phenyl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[3-[(1-naphthylmethylamino)methyl]phenyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[3-[(1-naphthalenylmethylamino)methyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[3-[(naphthalen-1-ylmethylamino)methyl]phenyl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[3-[(1-naphthylmethylamino)methyl]phenyl]benzimidazole-5-carboxylic acid Formula: C32H31N3O2 MolecularWeight: 489.60744

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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)CNCC5=CC=CC6=CC=CC=C65

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC(=CC=C4)CNCC5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C32H31N3O2/c36-32(37)25-16-17-30-29(19-25)34-31(35(30)27-13-2-1-3-14-27)24-11-6-8-22(18-24)20-33-21-26-12-7-10-23-9-4-5-15-28(23)26/h4-12,15-19,27,33H,1-3,13-14,20-21H2,(H,36,37)