methyl (E)-2-(3-methoxy-3-oxidanylidene-propyl)sulfanylhexadec-3-enoate

Systemtic Name: methyl (E)-2-(3-methoxy-3-oxidanylidene-propyl)sulfanylhexadec-3-enoate Openeye Name: methyl (E)-2-(3-methoxy-3-oxo-propyl)sulfanylhexadec-3-enoate CAS Name: (E)-2-[(3-methoxy-3-oxopropyl)thio]-3-hexadecenoic acid methyl ester IUPAC Name: methyl (E)-2-(3-methoxy-3-oxopropyl)sulfanylhexadec-3-enoate Traditional Name: (E)-2-[(3-keto-3-methoxy-propyl)thio]hexadec-3-enoic acid methyl ester Formula: C21H38O4S MolecularWeight: 386.58902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC=CC(C(=O)OC)SCCC(=O)OC

Isomeric SMILES

CCCCCCCCCCCC/C=C/C(C(=O)OC)SCCC(=O)OC

InChI

InChI=1S/C21H38O4S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19(21(23)25-3)26-18-17-20(22)24-2/h15-16,19H,4-14,17-18H2,1-3H3/b16-15+