N-(4-methylphenyl)-2-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethoxy]ethanamide

Systemtic Name: N-(4-methylphenyl)-2-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethoxy]ethanamide Openeye Name: 2-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethoxy]-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-[2-oxo-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethoxy]acetamide IUPAC Name: N-(4-methylphenyl)-2-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethoxy]acetamide Traditional Name: 2-[2-keto-2-(4-pyridin-1-ium-2-ylpiperazino)ethoxy]-N-(p-tolyl)acetamide Formula: C20H25N4O3+ MolecularWeight: 369.4375

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)COCC(=O)N2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)COCC(=O)N2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C20H24N4O3/c1-16-5-7-17(8-6-16)22-19(25)14-27-15-20(26)24-12-10-23(11-13-24)18-4-2-3-9-21-18/h2-9H,10-15H2,1H3,(H,22,25)/p+1