1-[3-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-yl]ethanone

Systemtic Name: 1-[3-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-yl]ethanone Openeye Name: 1-[3-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-4-oxido-1-oxo-quinoxalin-1-ium-2-yl]ethanone CAS Name: 1-[3-[[4-(4-methoxyphenyl)-1-piperazinyl]methyl]-4-oxido-1-oxo-2-quinoxalin-1-iumyl]ethanone IUPAC Name: 1-[3-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-4-oxido-1-oxoquinoxalin-1-ium-2-yl]ethanone Traditional Name: 1-[1-keto-3-[[4-(4-methoxyphenyl)piperazino]methyl]-4-oxido-quinoxalin-1-ium-2-yl]ethanone Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(C2=CC=CC=C2[N+]1=O)[O-])CN3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(=O)C1=C(N(C2=CC=CC=C2[N+]1=O)[O-])CN3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H24N4O4/c1-16(27)22-21(25(28)19-5-3-4-6-20(19)26(22)29)15-23-11-13-24(14-12-23)17-7-9-18(30-2)10-8-17/h3-10H,11-15H2,1-2H3