N-[5-chloranyl-2-(4-ethoxyphenoxy)phenyl]-2-(4-oxidanylpiperidin-1-ium-1-yl)ethanamide

Systemtic Name: N-[5-chloranyl-2-(4-ethoxyphenoxy)phenyl]-2-(4-oxidanylpiperidin-1-ium-1-yl)ethanamide Openeye Name: N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxypiperidin-1-ium-1-yl)acetamide CAS Name: N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxy-1-piperidin-1-iumyl)acetamide IUPAC Name: N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxypiperidin-1-ium-1-yl)acetamide Traditional Name: N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxypiperidin-1-ium-1-yl)acetamide Formula: C21H26ClN2O4+ MolecularWeight: 405.89514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)NC(=O)C[NH+]3CCC(CC3)O

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)NC(=O)C[NH+]3CCC(CC3)O

InChI

InChI=1S/C21H25ClN2O4/c1-2-27-17-4-6-18(7-5-17)28-20-8-3-15(22)13-19(20)23-21(26)14-24-11-9-16(25)10-12-24/h3-8,13,16,25H,2,9-12,14H2,1H3,(H,23,26)/p+1