4-methoxy-3-nitro-N-(2-oxidanylidene-1,3-benzoxathiol-5-yl)benzenesulfonamide

Systemtic Name: 4-methoxy-3-nitro-N-(2-oxidanylidene-1,3-benzoxathiol-5-yl)benzenesulfonamide Openeye Name: 4-methoxy-3-nitro-N-(2-oxo-1,3-benzoxathiol-5-yl)benzenesulfonamide CAS Name: 4-methoxy-3-nitro-N-(2-oxo-1,3-benzoxathiol-5-yl)benzenesulfonamide IUPAC Name: 4-methoxy-3-nitro-N-(2-oxo-1,3-benzoxathiol-5-yl)benzenesulfonamide Traditional Name: N-(2-keto-1,3-benzoxathiol-5-yl)-4-methoxy-3-nitro-benzenesulfonamide Formula: C14H10N2O7S2 MolecularWeight: 382.3684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OC(=O)S3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OC(=O)S3)[N+](=O)[O-]

InChI

InChI=1S/C14H10N2O7S2/c1-22-11-5-3-9(7-10(11)16(18)19)25(20,21)15-8-2-4-12-13(6-8)24-14(17)23-12/h2-7,15H,1H3