S-propan-2-yl (E)-6-oxidanylidenehex-2-enethioate

Systemtic Name: S-propan-2-yl (E)-6-oxidanylidenehex-2-enethioate Openeye Name: S-isopropyl (E)-6-oxohex-2-enethioate CAS Name: (E)-6-oxo-2-hexenethioic acid S-propan-2-yl ester IUPAC Name: S-propan-2-yl (E)-6-oxohex-2-enethioate Traditional Name: (E)-6-ketohex-2-enethioic acid S-isopropyl ester Formula: C9H14O2S MolecularWeight: 186.27126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC(=O)C=CCCC=O

Isomeric SMILES

CC(C)SC(=O)/C=C/CCC=O

InChI

InChI=1S/C9H14O2S/c1-8(2)12-9(11)6-4-3-5-7-10/h4,6-8H,3,5H2,1-2H3/b6-4+