[2-[(4-methylphenyl)methoxy]phenyl]methyl-(piperidin-1-ium-4-ylmethyl)azanium

Systemtic Name: [2-[(4-methylphenyl)methoxy]phenyl]methyl-(piperidin-1-ium-4-ylmethyl)azanium Openeye Name: piperidin-1-ium-4-ylmethyl-[[2-(p-tolylmethoxy)phenyl]methyl]ammonium CAS Name: [2-[(4-methylphenyl)methoxy]phenyl]methyl-(4-piperidin-1-iumylmethyl)ammonium IUPAC Name: [2-[(4-methylphenyl)methoxy]phenyl]methyl-(piperidin-1-ium-4-ylmethyl)azanium Traditional Name: [2-(4-methylbenzyl)oxybenzyl]-(piperidin-1-ium-4-ylmethyl)ammonium Formula: C21H30N2O+2 MolecularWeight: 326.4757

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=CC=CC=C2C[NH2+]CC3CC[NH2+]CC3

Isomeric SMILES

CC1=CC=C(C=C1)COC2=CC=CC=C2C[NH2+]CC3CC[NH2+]CC3

InChI

InChI=1S/C21H28N2O/c1-17-6-8-19(9-7-17)16-24-21-5-3-2-4-20(21)15-23-14-18-10-12-22-13-11-18/h2-9,18,22-23H,10-16H2,1H3/p+2