2-[3-[(4-fluorophenyl)amino]-3-oxidanylidene-propyl]sulfanylbenzoic acid

Systemtic Name: 2-[3-[(4-fluorophenyl)amino]-3-oxidanylidene-propyl]sulfanylbenzoic acid Openeye Name: 2-[3-(4-fluoroanilino)-3-oxo-propyl]sulfanylbenzoic acid CAS Name: 2-[[3-(4-fluoroanilino)-3-oxopropyl]thio]benzoic acid IUPAC Name: 2-[3-(4-fluoroanilino)-3-oxopropyl]sulfanylbenzoic acid Traditional Name: 2-[[3-(4-fluoroanilino)-3-keto-propyl]thio]benzoic acid Formula: C16H14FNO3S MolecularWeight: 319.350663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)SCCC(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)SCCC(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C16H14FNO3S/c17-11-5-7-12(8-6-11)18-15(19)9-10-22-14-4-2-1-3-13(14)16(20)21/h1-8H,9-10H2,(H,18,19)(H,20,21)