1-[(2-methylphenyl)methyl]-N-propyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2-methylphenyl)methyl]-N-propyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-(o-tolylmethyl)-N-propyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(2-methylphenyl)methyl]-N-propyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2-methylphenyl)methyl]-N-propylpiperidin-1-ium-4-carboxamide Traditional Name: 1-(2-methylbenzyl)-N-propyl-piperidin-1-ium-4-carboxamide Formula: C17H27N2O+ MolecularWeight: 275.40908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1CC[NH+](CC1)CC2=CC=CC=C2C

Isomeric SMILES

CCCNC(=O)C1CC[NH+](CC1)CC2=CC=CC=C2C

InChI

InChI=1S/C17H26N2O/c1-3-10-18-17(20)15-8-11-19(12-9-15)13-16-7-5-4-6-14(16)2/h4-7,15H,3,8-13H2,1-2H3,(H,18,20)/p+1