4-[(Z)-(6-fluoranyl-4-oxidanylidene-thiochromen-3-ylidene)methyl]-2-methoxy-6-nitro-phenolate

Systemtic Name: 4-[(Z)-(6-fluoranyl-4-oxidanylidene-thiochromen-3-ylidene)methyl]-2-methoxy-6-nitro-phenolate Openeye Name: 4-[(Z)-(6-fluoro-4-oxo-thiochroman-3-ylidene)methyl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[(Z)-(6-fluoro-4-oxo-1-benzothiopyran-3-ylidene)methyl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[(Z)-(6-fluoro-4-oxothiochromen-3-ylidene)methyl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[(Z)-(6-fluoro-4-keto-thiochroman-3-ylidene)methyl]-2-methoxy-6-nitro-phenolate Formula: C17H11FNO5S- MolecularWeight: 360.336343

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=C2CSC3=C(C2=O)C=C(C=C3)F

Isomeric SMILES

COC1=CC(=CC(=C1[O-])[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/p-1/b10-4+