(3,5-dimethoxyphenyl)methyl-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium

Systemtic Name: (3,5-dimethoxyphenyl)methyl-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium Openeye Name: (3,5-dimethoxyphenyl)methyl-(1-isopropylpiperidin-1-ium-4-yl)ammonium CAS Name: (3,5-dimethoxyphenyl)methyl-(1-propan-2-yl-4-piperidin-1-iumyl)ammonium IUPAC Name: (3,5-dimethoxyphenyl)methyl-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium Traditional Name: (3,5-dimethoxybenzyl)-(1-isopropylpiperidin-1-ium-4-yl)ammonium Formula: C17H30N2O2+2 MolecularWeight: 294.4323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)[NH2+]CC2=CC(=CC(=C2)OC)OC

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)[NH2+]CC2=CC(=CC(=C2)OC)OC

InChI

InChI=1S/C17H28N2O2/c1-13(2)19-7-5-15(6-8-19)18-12-14-9-16(20-3)11-17(10-14)21-4/h9-11,13,15,18H,5-8,12H2,1-4H3/p+2