(8-methyl-1-phenylsulfanyl-non-7-en-2-yl) ethanoate

Systemtic Name: (8-methyl-1-phenylsulfanyl-non-7-en-2-yl) ethanoate Openeye Name: [7-methyl-1-(phenylsulfanylmethyl)oct-6-enyl] acetate CAS Name: acetic acid [8-methyl-1-(phenylthio)non-7-en-2-yl] ester IUPAC Name: (8-methyl-1-phenylsulfanylnon-7-en-2-yl) acetate Traditional Name: acetic acid [7-methyl-1-[(phenylthio)methyl]oct-6-enyl] ester Formula: C18H26O2S MolecularWeight: 306.46284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26O2S/c1-15(2)10-6-4-7-11-17(20-16(3)19)14-21-18-12-8-5-9-13-18/h5,8-10,12-13,17H,4,6-7,11,14H2,1-3H3