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

Systemtic Name: 1-[3-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-6,7-dimethyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-yl]ethanone Openeye Name: 1-[3-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-6,7-dimethyl-4-oxido-1-oxo-quinoxalin-1-ium-2-yl]ethanone CAS Name: 1-[3-[[4-(4-chlorophenyl)-1-piperazinyl]methyl]-6,7-dimethyl-4-oxido-1-oxo-2-quinoxalin-1-iumyl]ethanone IUPAC Name: 1-[3-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-6,7-dimethyl-4-oxido-1-oxoquinoxalin-1-ium-2-yl]ethanone Traditional Name: 1-[3-[[4-(4-chlorophenyl)piperazino]methyl]-1-keto-6,7-dimethyl-4-oxido-quinoxalin-1-ium-2-yl]ethanone Formula: C23H25ClN4O3 MolecularWeight: 440.9226

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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)Cl)C(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C23H25ClN4O3/c1-15-12-20-21(13-16(15)2)28(31)23(17(3)29)22(27(20)30)14-25-8-10-26(11-9-25)19-6-4-18(24)5-7-19/h4-7,12-13H,8-11,14H2,1-3H3