1-[(2,4-dimethoxyphenyl)methyl]-N-(3-propan-2-yloxypropyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2,4-dimethoxyphenyl)methyl]-N-(3-propan-2-yloxypropyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[(2,4-dimethoxyphenyl)methyl]-N-(3-isopropoxypropyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(2,4-dimethoxyphenyl)methyl]-N-(3-propan-2-yloxypropyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2,4-dimethoxyphenyl)methyl]-N-(3-propan-2-yloxypropyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-(2,4-dimethoxybenzyl)-N-(3-isopropoxypropyl)piperidin-1-ium-4-carboxamide Formula: C21H35N2O4+ MolecularWeight: 379.5136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H34N2O4/c1-16(2)27-13-5-10-22-21(24)17-8-11-23(12-9-17)15-18-6-7-19(25-3)14-20(18)26-4/h6-7,14,16-17H,5,8-13,15H2,1-4H3,(H,22,24)/p+1