1-dodecoxy-2-(3-sulfanylbutyl)-1-tetradecoxy-hexadecan-1-ol

Systemtic Name: 1-dodecoxy-2-(3-sulfanylbutyl)-1-tetradecoxy-hexadecan-1-ol Openeye Name: 1-dodecoxy-2-(3-sulfanylbutyl)-1-tetradecoxy-hexadecan-1-ol CAS Name: 1-dodecoxy-2-(3-mercaptobutyl)-1-tetradecoxy-1-hexadecanol IUPAC Name: 1-dodecoxy-2-(3-sulfanylbutyl)-1-tetradecoxyhexadecan-1-ol Traditional Name: 1-lauryloxy-2-(3-mercaptobutyl)-1-myristyloxy-hexadecan-1-ol Formula: C46H94O3S MolecularWeight: 727.30176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(CCC(C)S)C(O)(OCCCCCCCCCCCC)OCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCC(CCC(C)S)C(O)(OCCCCCCCCCCCC)OCCCCCCCCCCCCCC

InChI

InChI=1S/C46H94O3S/c1-5-8-11-14-17-20-23-25-27-30-33-36-39-45(41-40-44(4)50)46(47,48-42-37-34-31-28-22-19-16-13-10-7-3)49-43-38-35-32-29-26-24-21-18-15-12-9-6-2/h44-45,47,50H,5-43H2,1-4H3