3-nitro-N-phenoxathiin-2-yl-benzenesulfonamide

Systemtic Name: 3-nitro-N-phenoxathiin-2-yl-benzenesulfonamide Openeye Name: 3-nitro-N-phenoxathiin-2-yl-benzenesulfonamide CAS Name: 3-nitro-N-(2-phenoxathiinyl)benzenesulfonamide IUPAC Name: 3-nitro-N-phenoxathiin-2-ylbenzenesulfonamide Traditional Name: 3-nitro-N-phenoxathiin-2-yl-benzenesulfonamide Formula: C18H12N2O5S2 MolecularWeight: 400.42828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)OC3=C(S2)C=C(C=C3)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)OC3=C(S2)C=C(C=C3)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H12N2O5S2/c21-20(22)13-4-3-5-14(11-13)27(23,24)19-12-8-9-16-18(10-12)26-17-7-2-1-6-15(17)25-16/h1-11,19H