7-(3-phenylsulfanyl-2-bicyclo[2.2.1]heptanyl)heptanoic acid

Systemtic Name: 7-(3-phenylsulfanyl-2-bicyclo[2.2.1]heptanyl)heptanoic acid Openeye Name: 7-(3-phenylsulfanylnorbornan-2-yl)heptanoic acid CAS Name: 7-[3-(phenylthio)-2-bicyclo[2.2.1]heptanyl]heptanoic acid IUPAC Name: 7-(3-phenylsulfanyl-2-bicyclo[2.2.1]heptanyl)heptanoic acid Traditional Name: 7-[3-(phenylthio)norbornan-2-yl]enanthic acid Formula: C20H28O2S MolecularWeight: 332.50012

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC1C(C2SC3=CC=CC=C3)CCCCCCC(=O)O

Isomeric SMILES

C1CC2CC1C(C2SC3=CC=CC=C3)CCCCCCC(=O)O

InChI

InChI=1S/C20H28O2S/c21-19(22)11-7-2-1-6-10-18-15-12-13-16(14-15)20(18)23-17-8-4-3-5-9-17/h3-5,8-9,15-16,18,20H,1-2,6-7,10-14H2,(H,21,22)