1-[2-(4-ethoxyphenoxy)ethyl]-N-(2-hydroxyphenyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-(4-ethoxyphenoxy)ethyl]-N-(2-hydroxyphenyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-(4-ethoxyphenoxy)ethyl]-N-(2-hydroxyphenyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[2-(4-ethoxyphenoxy)ethyl]-N-(2-hydroxyphenyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-(4-ethoxyphenoxy)ethyl]-N-(2-hydroxyphenyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-(4-ethoxyphenoxy)ethyl]-N-(2-hydroxyphenyl)piperidin-1-ium-4-carboxamide Formula: C22H29N2O4+ MolecularWeight: 385.47666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCC[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3O

Isomeric SMILES

CCOC1=CC=C(C=C1)OCC[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3O

InChI

InChI=1S/C22H28N2O4/c1-2-27-18-7-9-19(10-8-18)28-16-15-24-13-11-17(12-14-24)22(26)23-20-5-3-4-6-21(20)25/h3-10,17,25H,2,11-16H2,1H3,(H,23,26)/p+1