S-octyl 4-methylpent-3-enethioate

Systemtic Name: S-octyl 4-methylpent-3-enethioate Openeye Name: S-octyl 4-methylpent-3-enethioate CAS Name: 4-methyl-3-pentenethioic acid S-octyl ester IUPAC Name: S-octyl 4-methylpent-3-enethioate Traditional Name: 4-methylpent-3-enethioic acid S-octyl ester Formula: C14H26OS MolecularWeight: 242.42064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC(=O)CC=C(C)C

Isomeric SMILES

CCCCCCCCSC(=O)CC=C(C)C

InChI

InChI=1S/C14H26OS/c1-4-5-6-7-8-9-12-16-14(15)11-10-13(2)3/h10H,4-9,11-12H2,1-3H3