3-[[(1S)-4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl]amino]-4-oxidanyl-benzenesulfonamide

Systemtic Name: 3-[[(1S)-4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl]amino]-4-oxidanyl-benzenesulfonamide Openeye Name: 3-[[(1S)-4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl]amino]-4-hydroxy-benzenesulfonamide CAS Name: 3-[[(1S)-4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl]amino]-4-hydroxybenzenesulfonamide IUPAC Name: 3-[[(1S)-4,5-dimethoxy-3-oxo-1H-2-benzofuran-1-yl]amino]-4-hydroxybenzenesulfonamide Traditional Name: 4-hydroxy-3-[[(1S)-3-keto-4,5-dimethoxy-phthalan-1-yl]amino]benzenesulfonamide Formula: C16H16N2O7S MolecularWeight: 380.37244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)NC3=C(C=CC(=C3)S(=O)(=O)N)O)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)[C@H](OC2=O)NC3=C(C=CC(=C3)S(=O)(=O)N)O)OC

InChI

InChI=1S/C16H16N2O7S/c1-23-12-6-4-9-13(14(12)24-2)16(20)25-15(9)18-10-7-8(26(17,21)22)3-5-11(10)19/h3-7,15,18-19H,1-2H3,(H2,17,21,22)/t15-/m0/s1