7-(3-nitrophenyl)-5-oxidanyl-1,3-benzoxathiole-2-thione

Systemtic Name: 7-(3-nitrophenyl)-5-oxidanyl-1,3-benzoxathiole-2-thione Openeye Name: 5-hydroxy-7-(3-nitrophenyl)-1,3-benzoxathiole-2-thione CAS Name: 5-hydroxy-7-(3-nitrophenyl)-1,3-benzoxathiole-2-thione IUPAC Name: 5-hydroxy-7-(3-nitrophenyl)-1,3-benzoxathiole-2-thione Traditional Name: 5-hydroxy-7-(3-nitrophenyl)-1,3-benzoxathiole-2-thione Formula: C13H7NO4S2 MolecularWeight: 305.32898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC(=CC3=C2OC(=S)S3)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC(=CC3=C2OC(=S)S3)O

InChI

InChI=1S/C13H7NO4S2/c15-9-5-10(12-11(6-9)20-13(19)18-12)7-2-1-3-8(4-7)14(16)17/h1-6,15H