(2E)-2-cyano-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-(4-methoxyphenyl)ethanamide

Systemtic Name: (2E)-2-cyano-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-(4-methoxyphenyl)ethanamide Openeye Name: (2E)-2-cyano-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-(4-methoxyphenyl)acetamide CAS Name: (2E)-2-cyano-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-(4-methoxyphenyl)acetamide IUPAC Name: (2E)-2-cyano-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-(4-methoxyphenyl)acetamide Traditional Name: (2E)-2-cyano-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-(4-methoxyphenyl)acetamide Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=C(C#N)C(=O)NC3=CC=C(C=C3)OC)N1)C

Isomeric SMILES

CC1(CC2=CC=CC=C2/C(=C(/C#N)\C(=O)NC3=CC=C(C=C3)OC)/N1)C

InChI

InChI=1S/C21H21N3O2/c1-21(2)12-14-6-4-5-7-17(14)19(24-21)18(13-22)20(25)23-15-8-10-16(26-3)11-9-15/h4-11,24H,12H2,1-3H3,(H,23,25)/b19-18+