ethyl (2E,4Z)-5-(4-tert-butylphenyl)-5-chloranyl-2-cyano-penta-2,4-dienoate

Systemtic Name: ethyl (2E,4Z)-5-(4-tert-butylphenyl)-5-chloranyl-2-cyano-penta-2,4-dienoate Openeye Name: ethyl (2E,4Z)-5-(4-tert-butylphenyl)-5-chloro-2-cyano-penta-2,4-dienoate CAS Name: (2E,4Z)-5-(4-tert-butylphenyl)-5-chloro-2-cyanopenta-2,4-dienoic acid ethyl ester IUPAC Name: ethyl (2E,4Z)-5-(4-tert-butylphenyl)-5-chloro-2-cyanopenta-2,4-dienoate Traditional Name: (2E,4Z)-5-(4-tert-butylphenyl)-5-chloro-2-cyano-penta-2,4-dienoic acid ethyl ester Formula: C18H20ClNO2 MolecularWeight: 317.8099

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC=C(C1=CC=C(C=C1)C(C)(C)C)Cl)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C=C(/C1=CC=C(C=C1)C(C)(C)C)\Cl)/C#N

InChI

InChI=1S/C18H20ClNO2/c1-5-22-17(21)14(12-20)8-11-16(19)13-6-9-15(10-7-13)18(2,3)4/h6-11H,5H2,1-4H3/b14-8+,16-11-