[2-(2-nitrophenyl)sulfanyl-3-oxidanylidene-cyclohexen-1-yl] 3-fluoranylbenzoate

Systemtic Name: [2-(2-nitrophenyl)sulfanyl-3-oxidanylidene-cyclohexen-1-yl] 3-fluoranylbenzoate Openeye Name: [2-(2-nitrophenyl)sulfanyl-3-oxo-cyclohexen-1-yl] 3-fluorobenzoate CAS Name: 3-fluorobenzoic acid [2-[(2-nitrophenyl)thio]-3-oxo-1-cyclohexenyl] ester IUPAC Name: [2-(2-nitrophenyl)sulfanyl-3-oxocyclohexen-1-yl] 3-fluorobenzoate Traditional Name: 3-fluorobenzoic acid [3-keto-2-[(2-nitrophenyl)thio]cyclohexen-1-yl] ester Formula: C19H14FNO5S MolecularWeight: 387.381563

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C(=O)C1)SC2=CC=CC=C2[N+](=O)[O-])OC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

C1CC(=C(C(=O)C1)SC2=CC=CC=C2[N+](=O)[O-])OC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C19H14FNO5S/c20-13-6-3-5-12(11-13)19(23)26-16-9-4-8-15(22)18(16)27-17-10-2-1-7-14(17)21(24)25/h1-3,5-7,10-11H,4,8-9H2