[4-methoxy-4-[(E,3R,4R)-4-oxidanyl-7-phenylsulfanyl-oct-6-en-3-yl]oxy-butyl] 2,2-dimethylpropanoate

Systemtic Name: [4-methoxy-4-[(E,3R,4R)-4-oxidanyl-7-phenylsulfanyl-oct-6-en-3-yl]oxy-butyl] 2,2-dimethylpropanoate Openeye Name: [4-[(E,1R,2R)-1-ethyl-2-hydroxy-5-phenylsulfanyl-hex-4-enoxy]-4-methoxy-butyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-[(E,3R,4R)-4-hydroxy-7-(phenylthio)oct-6-en-3-yl]oxy-4-methoxybutyl] ester IUPAC Name: [4-[(E,3R,4R)-4-hydroxy-7-phenylsulfanyloct-6-en-3-yl]oxy-4-methoxybutyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-[(E,1R,2R)-1-ethyl-2-hydroxy-5-(phenylthio)hex-4-enoxy]-4-methoxy-butyl] ester Formula: C24H38O5S MolecularWeight: 438.62052

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CC=C(C)SC1=CC=CC=C1)O)OC(CCCOC(=O)C(C)(C)C)OC

Isomeric SMILES

CC[C@H]([C@@H](C/C=C(\C)/SC1=CC=CC=C1)O)OC(CCCOC(=O)C(C)(C)C)OC

InChI

InChI=1S/C24H38O5S/c1-7-21(20(25)16-15-18(2)30-19-12-9-8-10-13-19)29-22(27-6)14-11-17-28-23(26)24(3,4)5/h8-10,12-13,15,20-22,25H,7,11,14,16-17H2,1-6H3/b18-15+/t20-,21-,22?/m1/s1