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1-[6-nitro-2,3-bis(oxidanylidene)-1H-benzo[f]quinoxalin-4-yl]butylphosphonic acid

1-[6-nitro-2,3-bis(oxidanylidene)-1H-benzo[f]quinoxalin-4-yl]butylphosphonic acid

Systemtic Name:1-[6-nitro-2,3-bis(oxidanylidene)-1H-benzo[f]quinoxalin-4-yl]butylphosphonic acid
Openeye Name:1-(6-nitro-2,3-dioxo-1H-benzo[f]quinoxalin-4-yl)butylphosphonic acid
CAS Name:1-(6-nitro-2,3-dioxo-1H-benzo[f]quinoxalin-4-yl)butylphosphonic acid
IUPAC Name:1-(6-nitro-2,3-dioxo-1H-benzo[f]quinoxalin-4-yl)butylphosphonic acid
Traditional Name:1-(2,3-diketo-6-nitro-1H-benzo[f]quinoxalin-4-yl)butylphosphonic acid
Formula: C16H16N3O7P
MolecularWeight: 393.287901
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(N1C2=C(C3=CC=CC=C3C(=C2)[N+](=O)[O-])NC(=O)C1=O)P(=O)(O)O


Isomeric SMILES

CCCC(N1C2=C(C3=CC=CC=C3C(=C2)[N+](=O)[O-])NC(=O)C1=O)P(=O)(O)O


InChI

InChI=1S/C16H16N3O7P/c1-2-5-13(27(24,25)26)18-12-8-11(19(22)23)9-6-3-4-7-10(9)14(12)17-15(20)16(18)21/h3-4,6-8,13H,2,5H2,1H3,(H,17,20)(H2,24,25,26)


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