(4-methylphenyl)methyl-(1-propylpiperidin-1-ium-4-yl)azanium

Systemtic Name: (4-methylphenyl)methyl-(1-propylpiperidin-1-ium-4-yl)azanium Openeye Name: (1-propylpiperidin-1-ium-4-yl)-(p-tolylmethyl)ammonium CAS Name: (4-methylphenyl)methyl-(1-propyl-4-piperidin-1-iumyl)ammonium IUPAC Name: (4-methylphenyl)methyl-(1-propylpiperidin-1-ium-4-yl)azanium Traditional Name: (4-methylbenzyl)-(1-propylpiperidin-1-ium-4-yl)ammonium Formula: C16H28N2+2 MolecularWeight: 248.40692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)[NH2+]CC2=CC=C(C=C2)C

Isomeric SMILES

CCC[NH+]1CCC(CC1)[NH2+]CC2=CC=C(C=C2)C

InChI

InChI=1S/C16H26N2/c1-3-10-18-11-8-16(9-12-18)17-13-15-6-4-14(2)5-7-15/h4-7,16-17H,3,8-13H2,1-2H3/p+2