N-[1-methyl-2-[2-(4-methylpiperidin-1-ium-1-yl)ethyl]benzimidazol-5-yl]butanamide

Systemtic Name: N-[1-methyl-2-[2-(4-methylpiperidin-1-ium-1-yl)ethyl]benzimidazol-5-yl]butanamide Openeye Name: N-[1-methyl-2-[2-(4-methylpiperidin-1-ium-1-yl)ethyl]benzimidazol-5-yl]butanamide CAS Name: N-[1-methyl-2-[2-(4-methyl-1-piperidin-1-iumyl)ethyl]-5-benzimidazolyl]butanamide IUPAC Name: N-[1-methyl-2-[2-(4-methylpiperidin-1-ium-1-yl)ethyl]benzimidazol-5-yl]butanamide Traditional Name: N-[1-methyl-2-[2-(4-methylpiperidin-1-ium-1-yl)ethyl]benzimidazol-5-yl]butyramide Formula: C20H31N4O+ MolecularWeight: 343.48634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC2=C(C=C1)N(C(=N2)CC[NH+]3CCC(CC3)C)C

Isomeric SMILES

CCCC(=O)NC1=CC2=C(C=C1)N(C(=N2)CC[NH+]3CCC(CC3)C)C

InChI

InChI=1S/C20H30N4O/c1-4-5-20(25)21-16-6-7-18-17(14-16)22-19(23(18)3)10-13-24-11-8-15(2)9-12-24/h6-7,14-15H,4-5,8-13H2,1-3H3,(H,21,25)/p+1