(2-chloranyl-5-methyl-phenyl) 2-ethyl-4-[(4-methoxyphenyl)methylsulfanyl]-4-methyl-3-oxidanylidene-pentanoate

Systemtic Name: (2-chloranyl-5-methyl-phenyl) 2-ethyl-4-[(4-methoxyphenyl)methylsulfanyl]-4-methyl-3-oxidanylidene-pentanoate Openeye Name: (2-chloro-5-methyl-phenyl) 2-ethyl-4-[(4-methoxyphenyl)methylsulfanyl]-4-methyl-3-oxo-pentanoate CAS Name: 2-ethyl-4-[(4-methoxyphenyl)methylthio]-4-methyl-3-oxopentanoic acid (2-chloro-5-methylphenyl) ester IUPAC Name: (2-chloro-5-methylphenyl) 2-ethyl-4-[(4-methoxyphenyl)methylsulfanyl]-4-methyl-3-oxopentanoate Traditional Name: 2-ethyl-3-keto-4-methyl-4-(p-anisylthio)valeric acid (2-chloro-5-methyl-phenyl) ester Formula: C23H27ClO4S MolecularWeight: 434.97608

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C(C)(C)SCC1=CC=C(C=C1)OC)C(=O)OC2=C(C=CC(=C2)C)Cl

Isomeric SMILES

CCC(C(=O)C(C)(C)SCC1=CC=C(C=C1)OC)C(=O)OC2=C(C=CC(=C2)C)Cl

InChI

InChI=1S/C23H27ClO4S/c1-6-18(22(26)28-20-13-15(2)7-12-19(20)24)21(25)23(3,4)29-14-16-8-10-17(27-5)11-9-16/h7-13,18H,6,14H2,1-5H3