tert-butyl 3-cyano-3-(3,4-dichlorophenyl)propanoate

Systemtic Name: tert-butyl 3-cyano-3-(3,4-dichlorophenyl)propanoate Openeye Name: tert-butyl 3-cyano-3-(3,4-dichlorophenyl)propanoate CAS Name: 3-cyano-3-(3,4-dichlorophenyl)propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-cyano-3-(3,4-dichlorophenyl)propanoate Traditional Name: 3-cyano-3-(3,4-dichlorophenyl)propionic acid tert-butyl ester Formula: C14H15Cl2NO2 MolecularWeight: 300.1804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15Cl2NO2/c1-14(2,3)19-13(18)7-10(8-17)9-4-5-11(15)12(16)6-9/h4-6,10H,7H2,1-3H3