methyl 3-chloranyl-5-[1-(3-chloranyl-4-methoxy-5-methoxycarbonyl-phenyl)-6-ethylsulfanyl-6-oxidanylidene-hex-1-enyl]-2-methoxy-benzoate

Systemtic Name: methyl 3-chloranyl-5-[1-(3-chloranyl-4-methoxy-5-methoxycarbonyl-phenyl)-6-ethylsulfanyl-6-oxidanylidene-hex-1-enyl]-2-methoxy-benzoate Openeye Name: methyl 3-chloro-5-[1-(3-chloro-4-methoxy-5-methoxycarbonyl-phenyl)-6-ethylsulfanyl-6-oxo-hex-1-enyl]-2-methoxy-benzoate CAS Name: 3-chloro-5-[1-(3-chloro-4-methoxy-5-methoxycarbonylphenyl)-6-(ethylthio)-6-oxohex-1-enyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 3-chloro-5-[1-(3-chloro-4-methoxy-5-methoxycarbonylphenyl)-6-ethylsulfanyl-6-oxohex-1-enyl]-2-methoxybenzoate Traditional Name: 5-[1-(3-carbomethoxy-5-chloro-4-methoxy-phenyl)-6-(ethylthio)-6-keto-hex-1-enyl]-3-chloro-2-methoxy-benzoic acid methyl ester Formula: C26H28Cl2O7S MolecularWeight: 555.46732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)CCCC=C(C1=CC(=C(C(=C1)Cl)OC)C(=O)OC)C2=CC(=C(C(=C2)Cl)OC)C(=O)OC

Isomeric SMILES

CCSC(=O)CCCC=C(C1=CC(=C(C(=C1)Cl)OC)C(=O)OC)C2=CC(=C(C(=C2)Cl)OC)C(=O)OC

InChI

InChI=1S/C26H28Cl2O7S/c1-6-36-22(29)10-8-7-9-17(15-11-18(25(30)34-4)23(32-2)20(27)13-15)16-12-19(26(31)35-5)24(33-3)21(28)14-16/h9,11-14H,6-8,10H2,1-5H3