1-[3-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-6,7-dimethyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-yl]ethanone

Systemtic Name: 1-[3-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-6,7-dimethyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-yl]ethanone Openeye Name: 1-[3-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-6,7-dimethyl-4-oxido-1-oxo-quinoxalin-1-ium-2-yl]ethanone CAS Name: 1-[3-[[4-(4-methoxyphenyl)-1-piperazinyl]methyl]-6,7-dimethyl-4-oxido-1-oxo-2-quinoxalin-1-iumyl]ethanone IUPAC Name: 1-[3-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-6,7-dimethyl-4-oxido-1-oxoquinoxalin-1-ium-2-yl]ethanone Traditional Name: 1-[1-keto-3-[[4-(4-methoxyphenyl)piperazino]methyl]-6,7-dimethyl-4-oxido-quinoxalin-1-ium-2-yl]ethanone Formula: C24H28N4O4 MolecularWeight: 436.50352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)[N+](=O)C(=C(N2[O-])CN3CCN(CC3)C4=CC=C(C=C4)OC)C(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1C)[N+](=O)C(=C(N2[O-])CN3CCN(CC3)C4=CC=C(C=C4)OC)C(=O)C

InChI

InChI=1S/C24H28N4O4/c1-16-13-21-22(14-17(16)2)28(31)24(18(3)29)23(27(21)30)15-25-9-11-26(12-10-25)19-5-7-20(32-4)8-6-19/h5-8,13-14H,9-12,15H2,1-4H3