6-oxidanylidene-3-[[3-(phenylsulfonylamino)-1,4-dihydroquinoxalin-2-yl]imino]cyclohexa-1,4-diene-1-carboxylate

Systemtic Name: 6-oxidanylidene-3-[[3-(phenylsulfonylamino)-1,4-dihydroquinoxalin-2-yl]imino]cyclohexa-1,4-diene-1-carboxylate Openeye Name: 3-[[3-(benzenesulfonamido)-1,4-dihydroquinoxalin-2-yl]imino]-6-oxo-cyclohexa-1,4-diene-1-carboxylate CAS Name: 3-[[3-(benzenesulfonamido)-1,4-dihydroquinoxalin-2-yl]imino]-6-oxo-1-cyclohexa-1,4-dienecarboxylate IUPAC Name: 3-[[3-(benzenesulfonamido)-1,4-dihydroquinoxalin-2-yl]imino]-6-oxocyclohexa-1,4-diene-1-carboxylate Traditional Name: 3-[[3-(benzenesulfonamido)-1,4-dihydroquinoxalin-2-yl]imino]-6-keto-cyclohexa-1,4-diene-1-carboxylate Formula: C21H15N4O5S- MolecularWeight: 435.4326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC2=C(NC3=CC=CC=C3N2)N=C4C=CC(=O)C(=C4)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC2=C(NC3=CC=CC=C3N2)N=C4C=CC(=O)C(=C4)C(=O)[O-]

InChI

InChI=1S/C21H16N4O5S/c26-18-11-10-13(12-15(18)21(27)28)22-19-20(24-17-9-5-4-8-16(17)23-19)25-31(29,30)14-6-2-1-3-7-14/h1-12,23-25H,(H,27,28)/p-1