8,8-bis(3-chloranyl-4-methoxy-5-propanoyl-phenyl)oct-7-en-3-one

Systemtic Name: 8,8-bis(3-chloranyl-4-methoxy-5-propanoyl-phenyl)oct-7-en-3-one Openeye Name: 8,8-bis(3-chloro-4-methoxy-5-propanoyl-phenyl)oct-7-en-3-one CAS Name: 8,8-bis[3-chloro-4-methoxy-5-(1-oxopropyl)phenyl]-7-octen-3-one IUPAC Name: 8,8-bis(3-chloro-4-methoxy-5-propanoylphenyl)oct-7-en-3-one Traditional Name: 8,8-bis(3-chloro-4-methoxy-5-propionyl-phenyl)oct-7-en-3-one Formula: C28H32Cl2O5 MolecularWeight: 519.45668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H32Cl2O5/c1-6-19(31)11-9-10-12-20(17-13-21(25(32)7-2)27(34-4)23(29)15-17)18-14-22(26(33)8-3)28(35-5)24(30)16-18/h12-16H,6-11H2,1-5H3