N-(4-methoxyphenyl)-4-[(3-oxidanylidenepiperazin-1-ium-1-yl)methyl]benzamide

Systemtic Name: N-(4-methoxyphenyl)-4-[(3-oxidanylidenepiperazin-1-ium-1-yl)methyl]benzamide Openeye Name: N-(4-methoxyphenyl)-4-[(3-oxopiperazin-1-ium-1-yl)methyl]benzamide CAS Name: N-(4-methoxyphenyl)-4-[(3-oxo-1-piperazin-1-iumyl)methyl]benzamide IUPAC Name: N-(4-methoxyphenyl)-4-[(3-oxopiperazin-1-ium-1-yl)methyl]benzamide Traditional Name: 4-[(3-ketopiperazin-1-ium-1-yl)methyl]-N-(4-methoxyphenyl)benzamide Formula: C19H22N3O3+ MolecularWeight: 340.39628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C[NH+]3CCNC(=O)C3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C[NH+]3CCNC(=O)C3

InChI

InChI=1S/C19H21N3O3/c1-25-17-8-6-16(7-9-17)21-19(24)15-4-2-14(3-5-15)12-22-11-10-20-18(23)13-22/h2-9H,10-13H2,1H3,(H,20,23)(H,21,24)/p+1