3-(4-tert-butylphenyl)-N-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-cyano-prop-2-enamide

Systemtic Name: 3-(4-tert-butylphenyl)-N-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-cyano-prop-2-enamide Openeye Name: 3-(4-tert-butylphenyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-prop-2-enamide CAS Name: 3-(4-tert-butylphenyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-2-propenamide IUPAC Name: 3-(4-tert-butylphenyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide Traditional Name: 3-(4-tert-butylphenyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-acrylamide Formula: C21H18ClF3N2O MolecularWeight: 406.82863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C=C(C#N)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C=C(C#N)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl

InChI

InChI=1S/C21H18ClF3N2O/c1-20(2,3)15-6-4-13(5-7-15)10-14(12-26)19(28)27-18-11-16(21(23,24)25)8-9-17(18)22/h4-11H,1-3H3,(H,27,28)