3-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-carbonitrile

Systemtic Name: 3-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-carbonitrile Openeye Name: 3-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxido-4-oxo-quinoxalin-4-ium-2-carbonitrile CAS Name: 3-[4-(4-nitrophenyl)-1-piperazinyl]-1-oxido-4-oxo-2-quinoxalin-4-iumcarbonitrile IUPAC Name: 3-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxido-4-oxoquinoxalin-4-ium-2-carbonitrile Traditional Name: 4-keto-3-[4-(4-nitrophenyl)piperazino]-1-oxido-quinoxalin-4-ium-2-carbonitrile Formula: C19H16N6O4 MolecularWeight: 392.36814

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=C(N(C4=CC=CC=C4[N+]3=O)[O-])C#N

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=C(N(C4=CC=CC=C4[N+]3=O)[O-])C#N

InChI

InChI=1S/C19H16N6O4/c20-13-18-19(24(27)17-4-2-1-3-16(17)23(18)26)22-11-9-21(10-12-22)14-5-7-15(8-6-14)25(28)29/h1-8H,9-12H2