tert-butyl 4-[3-(dicyanomethylidene)-4-(dimethylaminomethylidene)pyrrolidin-1-yl]benzoate

Systemtic Name: tert-butyl 4-[3-(dicyanomethylidene)-4-(dimethylaminomethylidene)pyrrolidin-1-yl]benzoate Openeye Name: tert-butyl 4-[3-(dicyanomethylene)-4-(dimethylaminomethylene)pyrrolidin-1-yl]benzoate CAS Name: 4-[3-(dicyanomethylidene)-4-(dimethylaminomethylidene)-1-pyrrolidinyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(dicyanomethylidene)-4-(dimethylaminomethylidene)pyrrolidin-1-yl]benzoate Traditional Name: 4-[3-(dicyanomethylene)-4-(dimethylaminomethylene)pyrrolidino]benzoic acid tert-butyl ester Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC=C(C=C1)N2CC(=CN(C)C)C(=C(C#N)C#N)C2

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC=C(C=C1)N2CC(=CN(C)C)C(=C(C#N)C#N)C2

InChI

InChI=1S/C21H24N4O2/c1-21(2,3)27-20(26)15-6-8-18(9-7-15)25-13-17(12-24(4)5)19(14-25)16(10-22)11-23/h6-9,12H,13-14H2,1-5H3