S-phenyl (E)-2,4-dimethylhept-3-enethioate

Systemtic Name: S-phenyl (E)-2,4-dimethylhept-3-enethioate Openeye Name: S-phenyl (E)-2,4-dimethylhept-3-enethioate CAS Name: (E)-2,4-dimethyl-3-heptenethioic acid S-phenyl ester IUPAC Name: S-phenyl (E)-2,4-dimethylhept-3-enethioate Traditional Name: (E)-2,4-dimethylhept-3-enethioic acid S-phenyl ester Formula: C15H20OS MolecularWeight: 248.3837

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20OS/c1-4-8-12(2)11-13(3)15(16)17-14-9-6-5-7-10-14/h5-7,9-11,13H,4,8H2,1-3H3/b12-11+