methyl 2-[4-(3,3-dimethylbutanoylsulfanyl)phenyl]ethanoate

Systemtic Name: methyl 2-[4-(3,3-dimethylbutanoylsulfanyl)phenyl]ethanoate Openeye Name: methyl 2-[4-(3,3-dimethylbutanoylsulfanyl)phenyl]acetate CAS Name: 2-[4-[(3,3-dimethyl-1-oxobutyl)thio]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(3,3-dimethylbutanoylsulfanyl)phenyl]acetate Traditional Name: 2-[4-(3,3-dimethylbutanoylthio)phenyl]acetic acid methyl ester Formula: C15H20O3S MolecularWeight: 280.3825

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20O3S/c1-15(2,3)10-14(17)19-12-7-5-11(6-8-12)9-13(16)18-4/h5-8H,9-10H2,1-4H3