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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)[NH2+]CC2=CC=CC=C2C

Isomeric SMILES

CCC[NH+]1CCC(CC1)[NH2+]CC2=CC=CC=C2C

InChI

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