methyl 2-[3-chloranyl-4-[3-(4-propanoyl-2-propyl-phenoxy)propylsulfanyl]phenyl]ethanoate

Systemtic Name: methyl 2-[3-chloranyl-4-[3-(4-propanoyl-2-propyl-phenoxy)propylsulfanyl]phenyl]ethanoate Openeye Name: methyl 2-[3-chloro-4-[3-(4-propanoyl-2-propyl-phenoxy)propylsulfanyl]phenyl]acetate CAS Name: 2-[3-chloro-4-[3-[4-(1-oxopropyl)-2-propylphenoxy]propylthio]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-chloro-4-[3-(4-propanoyl-2-propylphenoxy)propylsulfanyl]phenyl]acetate Traditional Name: 2-[3-chloro-4-[3-(4-propionyl-2-propyl-phenoxy)propylthio]phenyl]acetic acid methyl ester Formula: C24H29ClO4S MolecularWeight: 449.00266

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)C(=O)CC)OCCCSC2=C(C=C(C=C2)CC(=O)OC)Cl

Isomeric SMILES

CCCC1=C(C=CC(=C1)C(=O)CC)OCCCSC2=C(C=C(C=C2)CC(=O)OC)Cl

InChI

InChI=1S/C24H29ClO4S/c1-4-7-19-16-18(21(26)5-2)9-10-22(19)29-12-6-13-30-23-11-8-17(14-20(23)25)15-24(27)28-3/h8-11,14,16H,4-7,12-13,15H2,1-3H3