3-(2-oxidanylidene-3-propyl-benzimidazol-1-yl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3-(2-oxidanylidene-3-propyl-benzimidazol-1-yl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 3-(2-oxo-3-propyl-benzimidazol-1-yl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]propanamide CAS Name: 3-(2-oxo-3-propyl-1-benzimidazolyl)-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]propanamide IUPAC Name: 3-(2-oxo-3-propylbenzimidazol-1-yl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 3-(2-keto-3-propyl-benzimidazol-1-yl)-N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]propionamide Formula: C26H35N4O2+ MolecularWeight: 435.5817

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N(C1=O)CCC(=O)NCC3=CC=C(C=C3)C[NH+]4CCCCC4

Isomeric SMILES

CCCN1C2=CC=CC=C2N(C1=O)CCC(=O)NCC3=CC=C(C=C3)C[NH+]4CCCCC4

InChI

InChI=1S/C26H34N4O2/c1-2-15-29-23-8-4-5-9-24(23)30(26(29)32)18-14-25(31)27-19-21-10-12-22(13-11-21)20-28-16-6-3-7-17-28/h4-5,8-13H,2-3,6-7,14-20H2,1H3,(H,27,31)/p+1