1-[(2,4-dimethoxyphenyl)methyl]-N-phenethyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2,4-dimethoxyphenyl)methyl]-N-phenethyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[(2,4-dimethoxyphenyl)methyl]-N-phenethyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(2,4-dimethoxyphenyl)methyl]-N-phenethyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2,4-dimethoxyphenyl)methyl]-N-phenethylpiperidin-1-ium-4-carboxamide Traditional Name: 1-(2,4-dimethoxybenzyl)-N-phenethyl-piperidin-1-ium-4-carboxamide Formula: C23H31N2O3+ MolecularWeight: 383.50384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C[NH+]2CCC(CC2)C(=O)NCCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C[NH+]2CCC(CC2)C(=O)NCCC3=CC=CC=C3)OC

InChI

InChI=1S/C23H30N2O3/c1-27-21-9-8-20(22(16-21)28-2)17-25-14-11-19(12-15-25)23(26)24-13-10-18-6-4-3-5-7-18/h3-9,16,19H,10-15,17H2,1-2H3,(H,24,26)/p+1