S-phenyl (E)-4-methylhex-3-enethioate

Systemtic Name: S-phenyl (E)-4-methylhex-3-enethioate Openeye Name: S-phenyl (E)-4-methylhex-3-enethioate CAS Name: (E)-4-methyl-3-hexenethioic acid S-phenyl ester IUPAC Name: S-phenyl (E)-4-methylhex-3-enethioate Traditional Name: (E)-4-methylhex-3-enethioic acid S-phenyl ester Formula: C13H16OS MolecularWeight: 220.33054

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CCC(=O)SC1=CC=CC=C1)C

Isomeric SMILES

CC/C(=C/CC(=O)SC1=CC=CC=C1)/C

InChI

InChI=1S/C13H16OS/c1-3-11(2)9-10-13(14)15-12-7-5-4-6-8-12/h4-9H,3,10H2,1-2H3/b11-9+