methyl 3-[3-(3-tert-butyl-5-methyl-2-oxidanyl-phenyl)propylsulfanyl]propanoate

Systemtic Name: methyl 3-[3-(3-tert-butyl-5-methyl-2-oxidanyl-phenyl)propylsulfanyl]propanoate Openeye Name: methyl 3-[3-(3-tert-butyl-2-hydroxy-5-methyl-phenyl)propylsulfanyl]propanoate CAS Name: 3-[3-(3-tert-butyl-2-hydroxy-5-methylphenyl)propylthio]propanoic acid methyl ester IUPAC Name: methyl 3-[3-(3-tert-butyl-2-hydroxy-5-methylphenyl)propylsulfanyl]propanoate Traditional Name: 3-[3-(3-tert-butyl-2-hydroxy-5-methyl-phenyl)propylthio]propionic acid methyl ester Formula: C18H28O3S MolecularWeight: 324.47812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(C)(C)C)O)CCCSCCC(=O)OC

Isomeric SMILES

CC1=CC(=C(C(=C1)C(C)(C)C)O)CCCSCCC(=O)OC

InChI

InChI=1S/C18H28O3S/c1-13-11-14(17(20)15(12-13)18(2,3)4)7-6-9-22-10-8-16(19)21-5/h11-12,20H,6-10H2,1-5H3