(E)-7-(3-phenethylsulfanyl-2-bicyclo[2.2.1]heptanyl)hept-5-enoic acid

Systemtic Name: (E)-7-(3-phenethylsulfanyl-2-bicyclo[2.2.1]heptanyl)hept-5-enoic acid Openeye Name: (E)-7-(3-phenethylsulfanylnorbornan-2-yl)hept-5-enoic acid CAS Name: (E)-7-[3-(phenethylthio)-2-bicyclo[2.2.1]heptanyl]-5-heptenoic acid IUPAC Name: (E)-7-(3-phenethylsulfanyl-2-bicyclo[2.2.1]heptanyl)hept-5-enoic acid Traditional Name: (E)-7-[3-(phenethylthio)norbornan-2-yl]hept-5-enoic acid Formula: C22H30O2S MolecularWeight: 358.5374

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC1C(C2SCCC3=CC=CC=C3)CC=CCCCC(=O)O

Isomeric SMILES

C1CC2CC1C(C2SCCC3=CC=CC=C3)C/C=C/CCCC(=O)O

InChI

InChI=1S/C22H30O2S/c23-21(24)11-7-2-1-6-10-20-18-12-13-19(16-18)22(20)25-15-14-17-8-4-3-5-9-17/h1,3-6,8-9,18-20,22H,2,7,10-16H2,(H,23,24)/b6-1+