methyl-(1-methylpiperidin-1-ium-4-yl)-[(2-prop-2-enoxyphenyl)methyl]azanium

Systemtic Name: methyl-(1-methylpiperidin-1-ium-4-yl)-[(2-prop-2-enoxyphenyl)methyl]azanium Openeye Name: (2-allyloxyphenyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: methyl-(1-methyl-4-piperidin-1-iumyl)-[(2-prop-2-enoxyphenyl)methyl]ammonium IUPAC Name: methyl-(1-methylpiperidin-1-ium-4-yl)-[(2-prop-2-enoxyphenyl)methyl]azanium Traditional Name: (2-allyloxybenzyl)-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C17H28N2O+2 MolecularWeight: 276.41702

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+](C)CC2=CC=CC=C2OCC=C

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+](C)CC2=CC=CC=C2OCC=C

InChI

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