ethyl 2-ethanoylsulfanyl-4-oxidanylidene-4-[4-(4-propan-2-ylphenoxy)phenyl]butanoate

Systemtic Name: ethyl 2-ethanoylsulfanyl-4-oxidanylidene-4-[4-(4-propan-2-ylphenoxy)phenyl]butanoate Openeye Name: ethyl 2-acetylsulfanyl-4-[4-(4-isopropylphenoxy)phenyl]-4-oxo-butanoate CAS Name: 2-(acetylthio)-4-oxo-4-[4-(4-propan-2-ylphenoxy)phenyl]butanoic acid ethyl ester IUPAC Name: ethyl 2-acetylsulfanyl-4-oxo-4-[4-(4-propan-2-ylphenoxy)phenyl]butanoate Traditional Name: 2-(acetylthio)-4-[4-(4-isopropylphenoxy)phenyl]-4-keto-butyric acid ethyl ester Formula: C23H26O5S MolecularWeight: 414.51454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)C(C)C)SC(=O)C

Isomeric SMILES

CCOC(=O)C(CC(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)C(C)C)SC(=O)C

InChI

InChI=1S/C23H26O5S/c1-5-27-23(26)22(29-16(4)24)14-21(25)18-8-12-20(13-9-18)28-19-10-6-17(7-11-19)15(2)3/h6-13,15,22H,5,14H2,1-4H3