[4-(4-fluorophenyl)carbonylphenyl] 2-(4-nitrophenyl)sulfanylethanoate

Systemtic Name: [4-(4-fluorophenyl)carbonylphenyl] 2-(4-nitrophenyl)sulfanylethanoate Openeye Name: [4-(4-fluorobenzoyl)phenyl] 2-(4-nitrophenyl)sulfanylacetate CAS Name: 2-[(4-nitrophenyl)thio]acetic acid [4-[(4-fluorophenyl)-oxomethyl]phenyl] ester IUPAC Name: [4-(4-fluorobenzoyl)phenyl] 2-(4-nitrophenyl)sulfanylacetate Traditional Name: 2-[(4-nitrophenyl)thio]acetic acid [4-(4-fluorobenzoyl)phenyl] ester Formula: C21H14FNO5S MolecularWeight: 411.402963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)F)OC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)F)OC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H14FNO5S/c22-16-5-1-14(2-6-16)21(25)15-3-9-18(10-4-15)28-20(24)13-29-19-11-7-17(8-12-19)23(26)27/h1-12H,13H2