4-(4-nitrophenyl)sulfanylbuta-2,3-dienyl 4-fluoranylbenzoate

Systemtic Name: 4-(4-nitrophenyl)sulfanylbuta-2,3-dienyl 4-fluoranylbenzoate Openeye Name: 4-(4-nitrophenyl)sulfanylbuta-2,3-dienyl 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid 4-[(4-nitrophenyl)thio]buta-2,3-dienyl ester IUPAC Name: 4-(4-nitrophenyl)sulfanylbuta-2,3-dienyl 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid 4-[(4-nitrophenyl)thio]buta-2,3-dienyl ester Formula: C17H12FNO4S MolecularWeight: 345.344883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC=C=CSC2=CC=C(C=C2)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC=C=CSC2=CC=C(C=C2)[N+](=O)[O-])F

InChI

InChI=1S/C17H12FNO4S/c18-14-5-3-13(4-6-14)17(20)23-11-1-2-12-24-16-9-7-15(8-10-16)19(21)22/h1,3-10,12H,11H2