(E)-3-(4-tert-butylphenyl)-N-(3-chloranyl-2-methyl-phenyl)-2-cyano-prop-2-enamide

Systemtic Name: (E)-3-(4-tert-butylphenyl)-N-(3-chloranyl-2-methyl-phenyl)-2-cyano-prop-2-enamide Openeye Name: (E)-3-(4-tert-butylphenyl)-N-(3-chloro-2-methyl-phenyl)-2-cyano-prop-2-enamide CAS Name: (E)-3-(4-tert-butylphenyl)-N-(3-chloro-2-methylphenyl)-2-cyano-2-propenamide IUPAC Name: (E)-3-(4-tert-butylphenyl)-N-(3-chloro-2-methylphenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-3-(4-tert-butylphenyl)-N-(3-chloro-2-methyl-phenyl)-2-cyano-acrylamide Formula: C21H21ClN2O MolecularWeight: 352.85724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C(=CC2=CC=C(C=C2)C(C)(C)C)C#N

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)/C(=C/C2=CC=C(C=C2)C(C)(C)C)/C#N

InChI

InChI=1S/C21H21ClN2O/c1-14-18(22)6-5-7-19(14)24-20(25)16(13-23)12-15-8-10-17(11-9-15)21(2,3)4/h5-12H,1-4H3,(H,24,25)/b16-12+