[2-(1-methylpiperidin-1-ium-4-yl)oxyphenyl]methylazanium

Systemtic Name: [2-(1-methylpiperidin-1-ium-4-yl)oxyphenyl]methylazanium Openeye Name: [2-(1-methylpiperidin-1-ium-4-yl)oxyphenyl]methylammonium CAS Name: [2-[(1-methyl-4-piperidin-1-iumyl)oxy]phenyl]methylammonium IUPAC Name: [2-(1-methylpiperidin-1-ium-4-yl)oxyphenyl]methylazanium Traditional Name: [2-(1-methylpiperidin-1-ium-4-yl)oxybenzyl]ammonium Formula: C13H22N2O+2 MolecularWeight: 222.32658

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)OC2=CC=CC=C2C[NH3+]

Isomeric SMILES

C[NH+]1CCC(CC1)OC2=CC=CC=C2C[NH3+]

InChI

InChI=1S/C13H20N2O/c1-15-8-6-12(7-9-15)16-13-5-3-2-4-11(13)10-14/h2-5,12H,6-10,14H2,1H3/p+2