dodecyl 3-(4-dodecoxy-4-oxidanylidene-butan-2-yl)sulfanylbutanoate

Systemtic Name: dodecyl 3-(4-dodecoxy-4-oxidanylidene-butan-2-yl)sulfanylbutanoate Openeye Name: dodecyl 3-(3-dodecoxy-1-methyl-3-oxo-propyl)sulfanylbutanoate CAS Name: 3-[(4-dodecoxy-4-oxobutan-2-yl)thio]butanoic acid dodecyl ester IUPAC Name: dodecyl 3-(4-dodecoxy-4-oxobutan-2-yl)sulfanylbutanoate Traditional Name: 3-[(3-keto-3-lauryloxy-1-methyl-propyl)thio]butyric acid lauryl ester Formula: C32H62O4S MolecularWeight: 542.89728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CC(C)SC(C)CC(=O)OCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC(C)SC(C)CC(=O)OCCCCCCCCCCCC

InChI

InChI=1S/C32H62O4S/c1-5-7-9-11-13-15-17-19-21-23-25-35-31(33)27-29(3)37-30(4)28-32(34)36-26-24-22-20-18-16-14-12-10-8-6-2/h29-30H,5-28H2,1-4H3