[(3E)-4,8-dimethyl-1-phenylsulfanyl-nona-3,7-dien-2-yl] ethanoate

Systemtic Name: [(3E)-4,8-dimethyl-1-phenylsulfanyl-nona-3,7-dien-2-yl] ethanoate Openeye Name: [(2E)-3,7-dimethyl-1-(phenylsulfanylmethyl)octa-2,6-dienyl] acetate CAS Name: acetic acid [(3E)-4,8-dimethyl-1-(phenylthio)nona-3,7-dien-2-yl] ester IUPAC Name: [(3E)-4,8-dimethyl-1-phenylsulfanylnona-3,7-dien-2-yl] acetate Traditional Name: acetic acid [(2E)-3,7-dimethyl-1-[(phenylthio)methyl]octa-2,6-dienyl] ester Formula: C19H26O2S MolecularWeight: 318.47354

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CC(CSC1=CC=CC=C1)OC(=O)C)C)C

Isomeric SMILES

CC(=CCC/C(=C/C(CSC1=CC=CC=C1)OC(=O)C)/C)C

InChI

InChI=1S/C19H26O2S/c1-15(2)9-8-10-16(3)13-18(21-17(4)20)14-22-19-11-6-5-7-12-19/h5-7,9,11-13,18H,8,10,14H2,1-4H3/b16-13+