4-butoxy-3-chloranyl-5-ethoxy-N-(3-oxidanylpyridin-1-ium-2-yl)benzamide

Systemtic Name: 4-butoxy-3-chloranyl-5-ethoxy-N-(3-oxidanylpyridin-1-ium-2-yl)benzamide Openeye Name: 4-butoxy-3-chloro-5-ethoxy-N-(3-hydroxypyridin-1-ium-2-yl)benzamide CAS Name: 4-butoxy-3-chloro-5-ethoxy-N-(3-hydroxy-2-pyridin-1-iumyl)benzamide IUPAC Name: 4-butoxy-3-chloro-5-ethoxy-N-(3-hydroxypyridin-1-ium-2-yl)benzamide Traditional Name: 4-butoxy-3-chloro-5-ethoxy-N-(3-hydroxypyridin-1-ium-2-yl)benzamide Formula: C18H22ClN2O4+ MolecularWeight: 365.83128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)C(=O)NC2=C(C=CC=[NH+]2)O)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)C(=O)NC2=C(C=CC=[NH+]2)O)OCC

InChI

InChI=1S/C18H21ClN2O4/c1-3-5-9-25-16-13(19)10-12(11-15(16)24-4-2)18(23)21-17-14(22)7-6-8-20-17/h6-8,10-11,22H,3-5,9H2,1-2H3,(H,20,21,23)/p+1