(3Z)-6-fluoranyl-3-[(3-methoxy-5-nitro-4-oxidanyl-phenyl)methylidene]thiochromen-4-one

Systemtic Name: (3Z)-6-fluoranyl-3-[(3-methoxy-5-nitro-4-oxidanyl-phenyl)methylidene]thiochromen-4-one Openeye Name: (3Z)-6-fluoro-3-[(4-hydroxy-3-methoxy-5-nitro-phenyl)methylene]thiochroman-4-one CAS Name: (3Z)-6-fluoro-3-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-1-benzothiopyran-4-one IUPAC Name: (3Z)-6-fluoro-3-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]thiochromen-4-one Traditional Name: (3Z)-6-fluoro-3-(4-hydroxy-3-methoxy-5-nitro-benzylidene)thiochroman-4-one Formula: C17H12FNO5S MolecularWeight: 361.344283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)[N+](=O)[O-])C=C2CSC3=C(C2=O)C=C(C=C3)F

Isomeric SMILES

COC1=CC(=CC(=C1O)[N+](=O)[O-])/C=C/2\CSC3=C(C2=O)C=C(C=C3)F

InChI

InChI=1S/C17H12FNO5S/c1-24-14-6-9(5-13(17(14)21)19(22)23)4-10-8-25-15-3-2-11(18)7-12(15)16(10)20/h2-7,21H,8H2,1H3/b10-4+