N-butyl-1-[(3-chlorophenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-butyl-1-[(3-chlorophenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-butyl-1-[(3-chlorophenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-butyl-1-[(3-chlorophenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-butyl-1-[(3-chlorophenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-butyl-1-(3-chlorobenzyl)piperidin-1-ium-4-carboxamide Formula: C17H26ClN2O+ MolecularWeight: 309.85414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1CC[NH+](CC1)CC2=CC(=CC=C2)Cl

Isomeric SMILES

CCCCNC(=O)C1CC[NH+](CC1)CC2=CC(=CC=C2)Cl

InChI

InChI=1S/C17H25ClN2O/c1-2-3-9-19-17(21)15-7-10-20(11-8-15)13-14-5-4-6-16(18)12-14/h4-6,12,15H,2-3,7-11,13H2,1H3,(H,19,21)/p+1