S-phenyl (E)-2-propylhept-3-enethioate

Systemtic Name: S-phenyl (E)-2-propylhept-3-enethioate Openeye Name: S-phenyl (E)-2-propylhept-3-enethioate CAS Name: (E)-2-propyl-3-heptenethioic acid S-phenyl ester IUPAC Name: S-phenyl (E)-2-propylhept-3-enethioate Traditional Name: (E)-2-propylhept-3-enethioic acid S-phenyl ester Formula: C16H22OS MolecularWeight: 262.41028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22OS/c1-3-5-7-11-14(10-4-2)16(17)18-15-12-8-6-9-13-15/h6-9,11-14H,3-5,10H2,1-2H3/b11-7+