propan-2-yl 2-[2,6-dimethyl-4-[3-(4-methylsulfanylphenyl)-3-oxidanylidene-propyl]phenoxy]-2-methyl-propanoate

Systemtic Name: propan-2-yl 2-[2,6-dimethyl-4-[3-(4-methylsulfanylphenyl)-3-oxidanylidene-propyl]phenoxy]-2-methyl-propanoate Openeye Name: isopropyl 2-[2,6-dimethyl-4-[3-(4-methylsulfanylphenyl)-3-oxo-propyl]phenoxy]-2-methyl-propanoate CAS Name: 2-[2,6-dimethyl-4-[3-[4-(methylthio)phenyl]-3-oxopropyl]phenoxy]-2-methylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[2,6-dimethyl-4-[3-(4-methylsulfanylphenyl)-3-oxopropyl]phenoxy]-2-methylpropanoate Traditional Name: 2-[4-[3-keto-3-[4-(methylthio)phenyl]propyl]-2,6-dimethyl-phenoxy]-2-methyl-propionic acid isopropyl ester Formula: C25H32O4S MolecularWeight: 428.58418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(C)(C)C(=O)OC(C)C)C)CCC(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

CC1=CC(=CC(=C1OC(C)(C)C(=O)OC(C)C)C)CCC(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C25H32O4S/c1-16(2)28-24(27)25(5,6)29-23-17(3)14-19(15-18(23)4)8-13-22(26)20-9-11-21(30-7)12-10-20/h9-12,14-16H,8,13H2,1-7H3