4-[[2-(ethylamino)-6-piperidin-1-ylcarbonyl-benzimidazol-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[2-(ethylamino)-6-piperidin-1-ylcarbonyl-benzimidazol-1-yl]methyl]benzoic acid Openeye Name: 4-[[2-(ethylamino)-6-(piperidine-1-carbonyl)benzimidazol-1-yl]methyl]benzoic acid CAS Name: 4-[[2-(ethylamino)-6-[oxo(1-piperidinyl)methyl]-1-benzimidazolyl]methyl]benzoic acid IUPAC Name: 4-[[2-(ethylamino)-6-(piperidine-1-carbonyl)benzimidazol-1-yl]methyl]benzoic acid Traditional Name: 4-[[2-(ethylamino)-6-(piperidine-1-carbonyl)benzimidazol-1-yl]methyl]benzoic acid Formula: C23H26N4O3 MolecularWeight: 406.47754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC2=C(N1CC3=CC=C(C=C3)C(=O)O)C=C(C=C2)C(=O)N4CCCCC4

Isomeric SMILES

CCNC1=NC2=C(N1CC3=CC=C(C=C3)C(=O)O)C=C(C=C2)C(=O)N4CCCCC4

InChI

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