4-(diethoxyphosphorylmethyl)-6-nitro-2,3-bis(oxidanylidene)-7-(sulfinatoamino)-1H-benzo[f]quinoxaline

Systemtic Name: 4-(diethoxyphosphorylmethyl)-6-nitro-2,3-bis(oxidanylidene)-7-(sulfinatoamino)-1H-benzo[f]quinoxaline Openeye Name: 4-(diethoxyphosphorylmethyl)-6-nitro-2,3-dioxo-7-(sulfinatoamino)-1H-benzo[f]quinoxaline CAS Name: 4-(diethoxyphosphorylmethyl)-6-nitro-2,3-dioxo-7-(sulfinatoamino)-1H-benzo[f]quinoxaline IUPAC Name: 4-(diethoxyphosphorylmethyl)-6-nitro-2,3-dioxo-7-(sulfinatoamino)-1H-benzo[f]quinoxaline Traditional Name: 4-(diethoxyphosphorylmethyl)-2,3-diketo-6-nitro-7-(sulfinatoamino)-1H-benzo[f]quinoxaline Formula: C17H18N4O9PS- MolecularWeight: 485.384981

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CN1C2=CC(=C3C(=C2NC(=O)C1=O)C=CC=C3NS(=O)[O-])[N+](=O)[O-])OCC

Isomeric SMILES

CCOP(=O)(CN1C2=CC(=C3C(=C2NC(=O)C1=O)C=CC=C3NS(=O)[O-])[N+](=O)[O-])OCC

InChI

InChI=1S/C17H19N4O9PS/c1-3-29-31(26,30-4-2)9-20-13-8-12(21(24)25)14-10(15(13)18-16(22)17(20)23)6-5-7-11(14)19-32(27)28/h5-8,19H,3-4,9H2,1-2H3,(H,18,22)(H,27,28)/p-1