3-(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)propanethioic S-acid

Systemtic Name: 3-(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)propanethioic S-acid Openeye Name: 3-(1,7,7-trimethylnorbornan-2-yl)propanethioic S-acid CAS Name: 3-(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)propanethioic S-acid IUPAC Name: 3-(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)propanethioic S-acid Traditional Name: 3-(2-bornyl)thiopropionic acid Formula: C13H22OS MolecularWeight: 226.37818

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(C2)CCC(=O)S)C)C

Isomeric SMILES

CC1(C2CCC1(C(C2)CCC(=O)S)C)C

InChI

InChI=1S/C13H22OS/c1-12(2)9-6-7-13(12,3)10(8-9)4-5-11(14)15/h9-10H,4-8H2,1-3H3,(H,14,15)