N-(4-ethoxyphenyl)-4-[2-(3-oxidanylpyridin-1-ium-1-yl)ethanoylamino]benzamide

Systemtic Name: N-(4-ethoxyphenyl)-4-[2-(3-oxidanylpyridin-1-ium-1-yl)ethanoylamino]benzamide Openeye Name: N-(4-ethoxyphenyl)-4-[[2-(3-hydroxypyridin-1-ium-1-yl)acetyl]amino]benzamide CAS Name: N-(4-ethoxyphenyl)-4-[[2-(3-hydroxy-1-pyridin-1-iumyl)-1-oxoethyl]amino]benzamide IUPAC Name: N-(4-ethoxyphenyl)-4-[[2-(3-hydroxypyridin-1-ium-1-yl)acetyl]amino]benzamide Traditional Name: 4-[[2-(3-hydroxypyridin-1-ium-1-yl)acetyl]amino]-N-p-phenetyl-benzamide Formula: C22H22N3O4+ MolecularWeight: 392.42778

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C[N+]3=CC=CC(=C3)O

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C[N+]3=CC=CC(=C3)O

InChI

InChI=1S/C22H21N3O4/c1-2-29-20-11-9-18(10-12-20)24-22(28)16-5-7-17(8-6-16)23-21(27)15-25-13-3-4-19(26)14-25/h3-14H,2,15H2,1H3,(H2-,23,24,26,27,28)/p+1