7-chloranyl-6-methoxy-3-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-carbonitrile

Systemtic Name: 7-chloranyl-6-methoxy-3-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-carbonitrile Openeye Name: 7-chloro-6-methoxy-3-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxido-4-oxo-quinoxalin-4-ium-2-carbonitrile CAS Name: 7-chloro-6-methoxy-3-[4-(4-nitrophenyl)-1-piperazinyl]-1-oxido-4-oxo-2-quinoxalin-4-iumcarbonitrile IUPAC Name: 7-chloro-6-methoxy-3-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxido-4-oxoquinoxalin-4-ium-2-carbonitrile Traditional Name: 7-chloro-4-keto-6-methoxy-3-[4-(4-nitrophenyl)piperazino]-1-oxido-quinoxalin-4-ium-2-carbonitrile Formula: C20H17ClN6O5 MolecularWeight: 456.83918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)[N+](=O)C(=C(N2[O-])C#N)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)[N+](=O)C(=C(N2[O-])C#N)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H17ClN6O5/c1-32-19-11-17-16(10-15(19)21)25(28)18(12-22)20(26(17)29)24-8-6-23(7-9-24)13-2-4-14(5-3-13)27(30)31/h2-5,10-11H,6-9H2,1H3