3-nitro-N-(2-oxidanylidene-1,3-benzoxathiol-5-yl)-N-(phenylsulfonyl)benzamide

Systemtic Name: 3-nitro-N-(2-oxidanylidene-1,3-benzoxathiol-5-yl)-N-(phenylsulfonyl)benzamide Openeye Name: N-(benzenesulfonyl)-3-nitro-N-(2-oxo-1,3-benzoxathiol-5-yl)benzamide CAS Name: N-(benzenesulfonyl)-3-nitro-N-(2-oxo-1,3-benzoxathiol-5-yl)benzamide IUPAC Name: N-(benzenesulfonyl)-3-nitro-N-(2-oxo-1,3-benzoxathiol-5-yl)benzamide Traditional Name: N-besyl-N-(2-keto-1,3-benzoxathiol-5-yl)-3-nitro-benzamide Formula: C20H12N2O7S2 MolecularWeight: 456.44848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=O)S3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=O)S3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H12N2O7S2/c23-19(13-5-4-6-15(11-13)22(25)26)21(31(27,28)16-7-2-1-3-8-16)14-9-10-17-18(12-14)30-20(24)29-17/h1-12H