(phenylmethyl) (E,2S)-2-(3,3-dimethoxypropylsulfanyl)-2-methyl-dec-3-enoate

Systemtic Name: (phenylmethyl) (E,2S)-2-(3,3-dimethoxypropylsulfanyl)-2-methyl-dec-3-enoate Openeye Name: benzyl (E,2S)-2-(3,3-dimethoxypropylsulfanyl)-2-methyl-dec-3-enoate CAS Name: (E,2S)-2-(3,3-dimethoxypropylthio)-2-methyl-3-decenoic acid (phenylmethyl) ester IUPAC Name: benzyl (E,2S)-2-(3,3-dimethoxypropylsulfanyl)-2-methyldec-3-enoate Traditional Name: (E,2S)-2-(3,3-dimethoxypropylthio)-2-methyl-dec-3-enoic acid benzyl ester Formula: C23H36O4S MolecularWeight: 408.59454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC(C)(C(=O)OCC1=CC=CC=C1)SCCC(OC)OC

Isomeric SMILES

CCCCCC/C=C/[C@@](C)(C(=O)OCC1=CC=CC=C1)SCCC(OC)OC

InChI

InChI=1S/C23H36O4S/c1-5-6-7-8-9-13-17-23(2,28-18-16-21(25-3)26-4)22(24)27-19-20-14-11-10-12-15-20/h10-15,17,21H,5-9,16,18-19H2,1-4H3/b17-13+/t23-/m0/s1