N-[(E)-1-cyano-1-(3,5-dimethylphenyl)-3,3-dimethyl-but-1-en-2-yl]-4-(dimethylamino)benzamide

Systemtic Name: N-[(E)-1-cyano-1-(3,5-dimethylphenyl)-3,3-dimethyl-but-1-en-2-yl]-4-(dimethylamino)benzamide Openeye Name: N-[(1E)-1-[cyano-(3,5-dimethylphenyl)methylene]-2,2-dimethyl-propyl]-4-(dimethylamino)benzamide CAS Name: N-[(E)-1-cyano-1-(3,5-dimethylphenyl)-3,3-dimethylbut-1-en-2-yl]-4-(dimethylamino)benzamide IUPAC Name: N-[(E)-1-cyano-1-(3,5-dimethylphenyl)-3,3-dimethylbut-1-en-2-yl]-4-(dimethylamino)benzamide Traditional Name: N-[(E)-1-tert-butyl-2-cyano-2-(3,5-dimethylphenyl)vinyl]-4-(dimethylamino)benzamide Formula: C24H29N3O MolecularWeight: 375.50656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=C(C(C)(C)C)NC(=O)C2=CC=C(C=C2)N(C)C)C#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)/C(=C(/C(C)(C)C)\NC(=O)C2=CC=C(C=C2)N(C)C)/C#N)C

InChI

InChI=1S/C24H29N3O/c1-16-12-17(2)14-19(13-16)21(15-25)22(24(3,4)5)26-23(28)18-8-10-20(11-9-18)27(6)7/h8-14H,1-7H3,(H,26,28)/b22-21-