1-[(3-methylphenyl)methyl]-N-propyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(3-methylphenyl)methyl]-N-propyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-(m-tolylmethyl)-N-propyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(3-methylphenyl)methyl]-N-propyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(3-methylphenyl)methyl]-N-propylpiperidin-1-ium-4-carboxamide Traditional Name: 1-(3-methylbenzyl)-N-propyl-piperidin-1-ium-4-carboxamide Formula: C17H27N2O+ MolecularWeight: 275.40908

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1CC[NH+](CC1)CC2=CC=CC(=C2)C

Isomeric SMILES

CCCNC(=O)C1CC[NH+](CC1)CC2=CC=CC(=C2)C

InChI

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