6-nitrospiro[3H-chromene-2,4'-thiane]-4-one

Systemtic Name: 6-nitrospiro[3H-chromene-2,4'-thiane]-4-one Openeye Name: 6-nitrospiro[chromane-2,4'-tetrahydrothiopyran]-4-one CAS Name: 6-nitro-4-spiro[3,4-dihydro-2H-1-benzopyran-2,4'-thiane]one IUPAC Name: 6-nitrospiro[3H-chromene-2,4'-thiane]-4-one Traditional Name: 6-nitrospiro[chroman-2,4'-tetrahydrothiopyran]-4-one Formula: C13H13NO4S MolecularWeight: 279.31162

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCC12CC(=O)C3=C(O2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CSCCC12CC(=O)C3=C(O2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H13NO4S/c15-11-8-13(3-5-19-6-4-13)18-12-2-1-9(14(16)17)7-10(11)12/h1-2,7H,3-6,8H2