N-(4-methylphenyl)sulfonyl-4-nitro-N-(2-oxidanylidenebenzo[g][1,3]benzoxathiol-5-yl)benzamide

Systemtic Name: N-(4-methylphenyl)sulfonyl-4-nitro-N-(2-oxidanylidenebenzo[g][1,3]benzoxathiol-5-yl)benzamide Openeye Name: 4-nitro-N-(2-oxobenzo[g][1,3]benzoxathiol-5-yl)-N-(p-tolylsulfonyl)benzamide CAS Name: N-(4-methylphenyl)sulfonyl-4-nitro-N-(2-oxo-5-benzo[g][1,3]benzoxathiolyl)benzamide IUPAC Name: N-(4-methylphenyl)sulfonyl-4-nitro-N-(2-oxobenzo[g][1,3]benzoxathiol-5-yl)benzamide Traditional Name: N-(2-ketobenzo[g][1,3]benzoxathiol-5-yl)-4-nitro-N-tosyl-benzamide Formula: C25H16N2O7S2 MolecularWeight: 520.53374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C4=CC=CC=C42)OC(=O)S3)C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C4=CC=CC=C42)OC(=O)S3)C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H16N2O7S2/c1-15-6-12-18(13-7-15)36(32,33)26(24(28)16-8-10-17(11-9-16)27(30)31)21-14-22-23(34-25(29)35-22)20-5-3-2-4-19(20)21/h2-14H,1H3