ethyl (4E,6E)-7-(3-chloranyl-2,4,6-trimethyl-phenyl)-2-ethanoyl-5-methyl-hepta-4,6-dienoate

Systemtic Name: ethyl (4E,6E)-7-(3-chloranyl-2,4,6-trimethyl-phenyl)-2-ethanoyl-5-methyl-hepta-4,6-dienoate Openeye Name: ethyl (4E,6E)-2-acetyl-7-(3-chloro-2,4,6-trimethyl-phenyl)-5-methyl-hepta-4,6-dienoate CAS Name: (4E,6E)-2-acetyl-7-(3-chloro-2,4,6-trimethylphenyl)-5-methylhepta-4,6-dienoic acid ethyl ester IUPAC Name: ethyl (4E,6E)-2-acetyl-7-(3-chloro-2,4,6-trimethylphenyl)-5-methylhepta-4,6-dienoate Traditional Name: (4E,6E)-2-acetyl-7-(3-chloro-2,4,6-trimethyl-phenyl)-5-methyl-hepta-4,6-dienoic acid ethyl ester Formula: C21H27ClO3 MolecularWeight: 362.89028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC=C(C)C=CC1=C(C(=C(C=C1C)C)Cl)C)C(=O)C

Isomeric SMILES

CCOC(=O)C(C/C=C(\C)/C=C/C1=C(C(=C(C=C1C)C)Cl)C)C(=O)C

InChI

InChI=1S/C21H27ClO3/c1-7-25-21(24)19(17(6)23)11-9-13(2)8-10-18-14(3)12-15(4)20(22)16(18)5/h8-10,12,19H,7,11H2,1-6H3/b10-8+,13-9+