(3,5-dimethoxy-4-oxidanyl-phenyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: (3,5-dimethoxy-4-oxidanyl-phenyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: (4-hydroxy-3,5-dimethoxy-phenyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: (4-hydroxy-3,5-dimethoxyphenyl)methyl-methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: (4-hydroxy-3,5-dimethoxyphenyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: (4-hydroxy-3,5-dimethoxy-benzyl)-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C16H28N2O3+2 MolecularWeight: 296.40512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2O3/c1-17-7-5-13(6-8-17)18(2)11-12-9-14(20-3)16(19)15(10-12)21-4/h9-10,13,19H,5-8,11H2,1-4H3/p+2