(4-fluoranyl-5,6-dimethoxy-1-benzothiophen-2-yl)methylimino-(oxidanylamino)methanesulfonic acid

Systemtic Name: (4-fluoranyl-5,6-dimethoxy-1-benzothiophen-2-yl)methylimino-(oxidanylamino)methanesulfonic acid Openeye Name: (4-fluoro-5,6-dimethoxy-benzothiophen-2-yl)methylimino-(hydroxyamino)methanesulfonic acid CAS Name: (4-fluoro-5,6-dimethoxy-1-benzothiophen-2-yl)methylimino-(hydroxyamino)methanesulfonic acid IUPAC Name: (4-fluoro-5,6-dimethoxy-1-benzothiophen-2-yl)methylimino-(hydroxyamino)methanesulfonic acid Traditional Name: (4-fluoro-5,6-dimethoxy-benzothiophen-2-yl)methylimino-(hydroxyamino)methanesulfonic acid Formula: C12H13FN2O6S2 MolecularWeight: 364.369823

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C(S2)CN=C(NO)S(=O)(=O)O)C(=C1OC)F

Isomeric SMILES

COC1=CC2=C(C=C(S2)CN=C(NO)S(=O)(=O)O)C(=C1OC)F

InChI

InChI=1S/C12H13FN2O6S2/c1-20-8-4-9-7(10(13)11(8)21-2)3-6(22-9)5-14-12(15-16)23(17,18)19/h3-4,16H,5H2,1-2H3,(H,14,15)(H,17,18,19)