1-cyclohexyl-2-[3-[(2-pyridin-3-ylethylamino)methyl]phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[3-[(2-pyridin-3-ylethylamino)methyl]phenyl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[3-[[2-(3-pyridyl)ethylamino]methyl]phenyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[3-[[2-(3-pyridinyl)ethylamino]methyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[3-[(2-pyridin-3-ylethylamino)methyl]phenyl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[3-[[2-(3-pyridyl)ethylamino]methyl]phenyl]benzimidazole-5-carboxylic acid Formula: C28H30N4O2 MolecularWeight: 454.5634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC(=CC=C4)CNCCC5=CN=CC=C5

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC(=CC=C4)CNCCC5=CN=CC=C5

InChI

InChI=1S/C28H30N4O2/c33-28(34)23-11-12-26-25(17-23)31-27(32(26)24-9-2-1-3-10-24)22-8-4-6-21(16-22)19-30-15-13-20-7-5-14-29-18-20/h4-8,11-12,14,16-18,24,30H,1-3,9-10,13,15,19H2,(H,33,34)