7,7-bis(3-chloranyl-5-ethylsulfanyl-4-methoxy-phenyl)hept-6-en-2-one

Systemtic Name: 7,7-bis(3-chloranyl-5-ethylsulfanyl-4-methoxy-phenyl)hept-6-en-2-one Openeye Name: 7,7-bis(3-chloro-5-ethylsulfanyl-4-methoxy-phenyl)hept-6-en-2-one CAS Name: 7,7-bis[3-chloro-5-(ethylthio)-4-methoxyphenyl]-6-hepten-2-one IUPAC Name: 7,7-bis(3-chloro-5-ethylsulfanyl-4-methoxyphenyl)hept-6-en-2-one Traditional Name: 7,7-bis[3-chloro-5-(ethylthio)-4-methoxy-phenyl]hept-6-en-2-one Formula: C25H30Cl2O3S2 MolecularWeight: 513.5399

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(=CC(=C1)C(=CCCCC(=O)C)C2=CC(=C(C(=C2)Cl)OC)SCC)Cl)OC

Isomeric SMILES

CCSC1=C(C(=CC(=C1)C(=CCCCC(=O)C)C2=CC(=C(C(=C2)Cl)OC)SCC)Cl)OC

InChI

InChI=1S/C25H30Cl2O3S2/c1-6-31-22-14-17(12-20(26)24(22)29-4)19(11-9-8-10-16(3)28)18-13-21(27)25(30-5)23(15-18)32-7-2/h11-15H,6-10H2,1-5H3