[3-(4-nitrophenyl)sulfanyl-2-oxidanylidene-chromen-4-yl] 4-fluoranylbenzoate

Systemtic Name: [3-(4-nitrophenyl)sulfanyl-2-oxidanylidene-chromen-4-yl] 4-fluoranylbenzoate Openeye Name: [3-(4-nitrophenyl)sulfanyl-2-oxo-chromen-4-yl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [3-[(4-nitrophenyl)thio]-2-oxo-1-benzopyran-4-yl] ester IUPAC Name: [3-(4-nitrophenyl)sulfanyl-2-oxochromen-4-yl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [2-keto-3-[(4-nitrophenyl)thio]chromen-4-yl] ester Formula: C22H12FNO6S MolecularWeight: 437.397183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C(=O)O2)SC3=CC=C(C=C3)[N+](=O)[O-])OC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C(=O)O2)SC3=CC=C(C=C3)[N+](=O)[O-])OC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H12FNO6S/c23-14-7-5-13(6-8-14)21(25)30-19-17-3-1-2-4-18(17)29-22(26)20(19)31-16-11-9-15(10-12-16)24(27)28/h1-12H