(E)-3-methylhept-2-enethioic S-acid

Systemtic Name: (E)-3-methylhept-2-enethioic S-acid Openeye Name: (E)-3-methylhept-2-enethioic S-acid CAS Name: (E)-3-methyl-2-heptenethioic S-acid IUPAC Name: (E)-3-methylhept-2-enethioic S-acid Traditional Name: (E)-3-methylhept-2-enethioic S-acid Formula: C8H14OS MolecularWeight: 158.26116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=CC(=O)S)C

Isomeric SMILES

CCCC/C(=C/C(=O)S)/C

InChI

InChI=1S/C8H14OS/c1-3-4-5-7(2)6-8(9)10/h6H,3-5H2,1-2H3,(H,9,10)/b7-6+