N-[1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]-N-(4-methoxyphenyl)-2-nitro-benzenesulfonamide

Systemtic Name: N-[1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]-N-(4-methoxyphenyl)-2-nitro-benzenesulfonamide Openeye Name: N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-N-(4-methoxyphenyl)-2-nitro-benzenesulfonamide CAS Name: N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-N-(4-methoxyphenyl)-2-nitrobenzenesulfonamide IUPAC Name: N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-N-(4-methoxyphenyl)-2-nitrobenzenesulfonamide Traditional Name: N-(1,1-diketo-2,3-dihydrothiophen-3-yl)-N-(4-methoxyphenyl)-2-nitro-benzenesulfonamide Formula: C17H16N2O7S2 MolecularWeight: 424.44814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(C2CS(=O)(=O)C=C2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N(C2CS(=O)(=O)C=C2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O7S2/c1-26-15-8-6-13(7-9-15)18(14-10-11-27(22,23)12-14)28(24,25)17-5-3-2-4-16(17)19(20)21/h2-11,14H,12H2,1H3