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

Systemtic Name: methyl 2-[4-[3-(3-acetyloxy-4-propanoyl-2-propyl-phenoxy)propylsulfanyl]-3-chloranyl-phenyl]ethanoate Openeye Name: methyl 2-[4-[3-(3-acetoxy-4-propanoyl-2-propyl-phenoxy)propylsulfanyl]-3-chloro-phenyl]acetate CAS Name: 2-[4-[3-[3-acetyloxy-4-(1-oxopropyl)-2-propylphenoxy]propylthio]-3-chlorophenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[3-(3-acetyloxy-4-propanoyl-2-propylphenoxy)propylsulfanyl]-3-chlorophenyl]acetate Traditional Name: 2-[4-[3-(3-acetoxy-4-propionyl-2-propyl-phenoxy)propylthio]-3-chloro-phenyl]acetic acid methyl ester Formula: C26H31ClO6S MolecularWeight: 507.03874

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1OC(=O)C)C(=O)CC)OCCCSC2=C(C=C(C=C2)CC(=O)OC)Cl

Isomeric SMILES

CCCC1=C(C=CC(=C1OC(=O)C)C(=O)CC)OCCCSC2=C(C=C(C=C2)CC(=O)OC)Cl

InChI

InChI=1S/C26H31ClO6S/c1-5-8-20-23(11-10-19(22(29)6-2)26(20)33-17(3)28)32-13-7-14-34-24-12-9-18(15-21(24)27)16-25(30)31-4/h9-12,15H,5-8,13-14,16H2,1-4H3