2-[1-[(2,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]ethyl-methyl-azanium

Systemtic Name: 2-[1-[(2,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]ethyl-methyl-azanium Openeye Name: 2-[1-[(2,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]ethyl-methyl-ammonium CAS Name: 2-[1-[(2,5-dimethoxyphenyl)methyl]-4-piperidin-1-iumyl]ethyl-methylammonium IUPAC Name: 2-[1-[(2,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]ethyl-methylazanium Traditional Name: 2-[1-(2,5-dimethoxybenzyl)piperidin-1-ium-4-yl]ethyl-methyl-ammonium Formula: C17H30N2O2+2 MolecularWeight: 294.4323

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CCC1CC[NH+](CC1)CC2=C(C=CC(=C2)OC)OC

Isomeric SMILES

C[NH2+]CCC1CC[NH+](CC1)CC2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C17H28N2O2/c1-18-9-6-14-7-10-19(11-8-14)13-15-12-16(20-2)4-5-17(15)21-3/h4-5,12,14,18H,6-11,13H2,1-3H3/p+2