[4-(1,3-dithiolan-2-yl)phenyl] 2,3-bis(oxidanylidene)-1,4-dihydroquinoxaline-6-sulfonate

Systemtic Name: [4-(1,3-dithiolan-2-yl)phenyl] 2,3-bis(oxidanylidene)-1,4-dihydroquinoxaline-6-sulfonate Openeye Name: [4-(1,3-dithiolan-2-yl)phenyl] 2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonate CAS Name: 2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonic acid [4-(1,3-dithiolan-2-yl)phenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)phenyl] 2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonate Traditional Name: 2,3-diketo-1,4-dihydroquinoxaline-6-sulfonic acid [4-(1,3-dithiolan-2-yl)phenyl] ester Formula: C17H14N2O5S3 MolecularWeight: 422.49846

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC4=C(C=C3)NC(=O)C(=O)N4

Isomeric SMILES

C1CSC(S1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC4=C(C=C3)NC(=O)C(=O)N4

InChI

InChI=1S/C17H14N2O5S3/c20-15-16(21)19-14-9-12(5-6-13(14)18-15)27(22,23)24-11-3-1-10(2-4-11)17-25-7-8-26-17/h1-6,9,17H,7-8H2,(H,18,20)(H,19,21)