1-(4-methylphenyl)sulfonyl-3-[6-nitro-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]urea

Systemtic Name: 1-(4-methylphenyl)sulfonyl-3-[6-nitro-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]urea Openeye Name: 1-(6-nitro-2,3-dioxo-4H-quinoxalin-1-yl)-3-(p-tolylsulfonyl)urea CAS Name: 1-(4-methylphenyl)sulfonyl-3-(6-nitro-2,3-dioxo-4H-quinoxalin-1-yl)urea IUPAC Name: 1-(4-methylphenyl)sulfonyl-3-(6-nitro-2,3-dioxo-4H-quinoxalin-1-yl)urea Traditional Name: 1-(2,3-diketo-6-nitro-4H-quinoxalin-1-yl)-3-tosyl-urea Formula: C16H13N5O7S MolecularWeight: 419.36872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NN2C3=C(C=C(C=C3)[N+](=O)[O-])NC(=O)C2=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NN2C3=C(C=C(C=C3)[N+](=O)[O-])NC(=O)C2=O

InChI

InChI=1S/C16H13N5O7S/c1-9-2-5-11(6-3-9)29(27,28)19-16(24)18-20-13-7-4-10(21(25)26)8-12(13)17-14(22)15(20)23/h2-8H,1H3,(H,17,22)(H2,18,19,24)