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

Systemtic Name: 1-[(2,3-dimethoxyphenyl)methyl]-N-phenethyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[(2,3-dimethoxyphenyl)methyl]-N-phenethyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(2,3-dimethoxyphenyl)methyl]-N-phenethyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2,3-dimethoxyphenyl)methyl]-N-phenethylpiperidin-1-ium-4-carboxamide Traditional Name: 1-o-veratryl-N-phenethyl-piperidin-1-ium-4-carboxamide Formula: C23H31N2O3+ MolecularWeight: 383.50384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C[NH+]2CCC(CC2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1OC)C[NH+]2CCC(CC2)C(=O)NCCC3=CC=CC=C3

InChI

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