7-phenyl-3-phenylsulfanyl-heptanoic acid

Systemtic Name: 7-phenyl-3-phenylsulfanyl-heptanoic acid Openeye Name: 7-phenyl-3-phenylsulfanyl-heptanoic acid CAS Name: 7-phenyl-3-(phenylthio)heptanoic acid IUPAC Name: 7-phenyl-3-phenylsulfanylheptanoic acid Traditional Name: 7-phenyl-3-(phenylthio)enanthic acid Formula: C19H22O2S MolecularWeight: 314.44178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCC(CC(=O)O)SC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CCCCC(CC(=O)O)SC2=CC=CC=C2

InChI

InChI=1S/C19H22O2S/c20-19(21)15-18(22-17-12-5-2-6-13-17)14-8-7-11-16-9-3-1-4-10-16/h1-6,9-10,12-13,18H,7-8,11,14-15H2,(H,20,21)