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

Systemtic Name: 7,7-bis(3-chloranyl-5-ethanoyl-4-methyl-phenyl)hept-6-en-2-one Openeye Name: 7,7-bis(3-acetyl-5-chloro-4-methyl-phenyl)hept-6-en-2-one CAS Name: 7,7-bis(3-acetyl-5-chloro-4-methylphenyl)-6-hepten-2-one IUPAC Name: 7,7-bis(3-acetyl-5-chloro-4-methylphenyl)hept-6-en-2-one Traditional Name: 7,7-bis(3-acetyl-5-chloro-4-methyl-phenyl)hept-6-en-2-one Formula: C25H26Cl2O3 MolecularWeight: 445.37814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1Cl)C(=CCCCC(=O)C)C2=CC(=C(C(=C2)Cl)C)C(=O)C)C(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1Cl)C(=CCCCC(=O)C)C2=CC(=C(C(=C2)Cl)C)C(=O)C)C(=O)C

InChI

InChI=1S/C25H26Cl2O3/c1-14(28)8-6-7-9-21(19-10-22(17(4)29)15(2)24(26)12-19)20-11-23(18(5)30)16(3)25(27)13-20/h9-13H,6-8H2,1-5H3