hexadecyl 2-(1-hexadecoxy-1-oxidanylidene-propan-2-yl)sulfanylpropanoate

Systemtic Name: hexadecyl 2-(1-hexadecoxy-1-oxidanylidene-propan-2-yl)sulfanylpropanoate Openeye Name: hexadecyl 2-(2-hexadecoxy-1-methyl-2-oxo-ethyl)sulfanylpropanoate CAS Name: 2-[(1-hexadecoxy-1-oxopropan-2-yl)thio]propanoic acid hexadecyl ester IUPAC Name: hexadecyl 2-(1-hexadecoxy-1-oxopropan-2-yl)sulfanylpropanoate Traditional Name: 2-[(2-cetyloxy-2-keto-1-methyl-ethyl)thio]propionic acid cetyl ester Formula: C38H74O4S MolecularWeight: 627.05676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C(C)SC(C)C(=O)OCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)C(C)SC(C)C(=O)OCCCCCCCCCCCCCCCC

InChI

InChI=1S/C38H74O4S/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41-37(39)35(3)43-36(4)38(40)42-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h35-36H,5-34H2,1-4H3