4-[2-(9-butylsulfinylnonanoylamino)-5-(fluoranylmethyl)phenyl]sulfanylbutanoic acid

Systemtic Name: 4-[2-(9-butylsulfinylnonanoylamino)-5-(fluoranylmethyl)phenyl]sulfanylbutanoic acid Openeye Name: 4-[2-(9-butylsulfinylnonanoylamino)-5-(fluoromethyl)phenyl]sulfanylbutanoic acid CAS Name: 4-[[2-[(9-butylsulfinyl-1-oxononyl)amino]-5-(fluoromethyl)phenyl]thio]butanoic acid IUPAC Name: 4-[2-(9-butylsulfinylnonanoylamino)-5-(fluoromethyl)phenyl]sulfanylbutanoic acid Traditional Name: 4-[[2-(9-butylsulfinylnonanoylamino)-5-(fluoromethyl)phenyl]thio]butyric acid Formula: C24H38FNO4S2 MolecularWeight: 487.691223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)CCCCCCCCC(=O)NC1=C(C=C(C=C1)CF)SCCCC(=O)O

Isomeric SMILES

CCCCS(=O)CCCCCCCCC(=O)NC1=C(C=C(C=C1)CF)SCCCC(=O)O

InChI

InChI=1S/C24H38FNO4S2/c1-2-3-16-32(30)17-9-7-5-4-6-8-11-23(27)26-21-14-13-20(19-25)18-22(21)31-15-10-12-24(28)29/h13-14,18H,2-12,15-17,19H2,1H3,(H,26,27)(H,28,29)