[(E)-2-oxidanylidenedec-6-en-4-yl] 3-[3-[3-methoxy-5-(phenylmethylsulfanyl)pentanoyl]oxybutanoyloxy]heptanoate

Systemtic Name: [(E)-2-oxidanylidenedec-6-en-4-yl] 3-[3-[3-methoxy-5-(phenylmethylsulfanyl)pentanoyl]oxybutanoyloxy]heptanoate Openeye Name: [(E)-1-acetonylhept-3-enyl] 3-[3-(5-benzylsulfanyl-3-methoxy-pentanoyl)oxybutanoyloxy]heptanoate CAS Name: 3-[3-[3-methoxy-1-oxo-5-(phenylmethylthio)pentoxy]-1-oxobutoxy]heptanoic acid [(E)-2-oxodec-6-en-4-yl] ester IUPAC Name: [(E)-2-oxodec-6-en-4-yl] 3-[3-(5-benzylsulfanyl-3-methoxypentanoyl)oxybutanoyloxy]heptanoate Traditional Name: 3-[3-[5-(benzylthio)-3-methoxy-pentanoyl]oxybutanoyloxy]enanthic acid [(E)-1-acetonylhept-3-enyl] ester Formula: C34H52O8S MolecularWeight: 620.83688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=O)OC(CC=CCCC)CC(=O)C)OC(=O)CC(C)OC(=O)CC(CCSCC1=CC=CC=C1)OC

Isomeric SMILES

CCCCC(CC(=O)OC(C/C=C/CCC)CC(=O)C)OC(=O)CC(C)OC(=O)CC(CCSCC1=CC=CC=C1)OC

InChI

InChI=1S/C34H52O8S/c1-6-8-10-14-18-30(21-26(3)35)41-34(38)24-31(17-9-7-2)42-32(36)22-27(4)40-33(37)23-29(39-5)19-20-43-25-28-15-12-11-13-16-28/h10-16,27,29-31H,6-9,17-25H2,1-5H3/b14-10+