N-butyl-4-(piperidin-1-ium-1-ylmethyl)benzamide

Systemtic Name: N-butyl-4-(piperidin-1-ium-1-ylmethyl)benzamide Openeye Name: N-butyl-4-(piperidin-1-ium-1-ylmethyl)benzamide CAS Name: N-butyl-4-(1-piperidin-1-iumylmethyl)benzamide IUPAC Name: N-butyl-4-(piperidin-1-ium-1-ylmethyl)benzamide Traditional Name: N-butyl-4-(piperidin-1-ium-1-ylmethyl)benzamide Formula: C17H27N2O+ MolecularWeight: 275.40908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=C(C=C1)C[NH+]2CCCCC2

Isomeric SMILES

CCCCNC(=O)C1=CC=C(C=C1)C[NH+]2CCCCC2

InChI

InChI=1S/C17H26N2O/c1-2-3-11-18-17(20)16-9-7-15(8-10-16)14-19-12-5-4-6-13-19/h7-10H,2-6,11-14H2,1H3,(H,18,20)/p+1