1-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]-N-ethyl-N-(2-methylprop-2-enyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]-N-ethyl-N-(2-methylprop-2-enyl)piperidin-1-ium-4-carboxamide Openeye Name: N-ethyl-1-[(4-hydroxy-3,5-dimethoxy-phenyl)methyl]-N-(2-methylallyl)piperidin-1-ium-4-carboxamide CAS Name: N-ethyl-1-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-N-(2-methylprop-2-enyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-ethyl-1-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-N-(2-methylprop-2-enyl)piperidin-1-ium-4-carboxamide Traditional Name: N-ethyl-1-(4-hydroxy-3,5-dimethoxy-benzyl)-N-(2-methylallyl)piperidin-1-ium-4-carboxamide Formula: C21H33N2O4+ MolecularWeight: 377.49772

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=C)C)C(=O)C1CC[NH+](CC1)CC2=CC(=C(C(=C2)OC)O)OC

Isomeric SMILES

CCN(CC(=C)C)C(=O)C1CC[NH+](CC1)CC2=CC(=C(C(=C2)OC)O)OC

InChI

InChI=1S/C21H32N2O4/c1-6-23(13-15(2)3)21(25)17-7-9-22(10-8-17)14-16-11-18(26-4)20(24)19(12-16)27-5/h11-12,17,24H,2,6-10,13-14H2,1,3-5H3/p+1