ethyl 5-tert-butyl-7,7,8,8-tetracyano-2-methyl-9-azabicyclo[4.2.1]nona-2,4-diene-9-carboxylate

Systemtic Name: ethyl 5-tert-butyl-7,7,8,8-tetracyano-2-methyl-9-azabicyclo[4.2.1]nona-2,4-diene-9-carboxylate Openeye Name: ethyl 5-tert-butyl-7,7,8,8-tetracyano-2-methyl-9-azabicyclo[4.2.1]nona-2,4-diene-9-carboxylate CAS Name: 5-tert-butyl-7,7,8,8-tetracyano-2-methyl-9-azabicyclo[4.2.1]nona-2,4-diene-9-carboxylic acid ethyl ester IUPAC Name: ethyl 5-tert-butyl-7,7,8,8-tetracyano-2-methyl-9-azabicyclo[4.2.1]nona-2,4-diene-9-carboxylate Traditional Name: 5-tert-butyl-7,7,8,8-tetracyano-2-methyl-9-azabicyclo[4.2.1]nona-2,4-diene-9-carboxylic acid ethyl ester Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2C(=CC=C(C1C(C2(C#N)C#N)(C#N)C#N)C(C)(C)C)C

Isomeric SMILES

CCOC(=O)N1C2C(=CC=C(C1C(C2(C#N)C#N)(C#N)C#N)C(C)(C)C)C

InChI

InChI=1S/C20H21N5O2/c1-6-27-17(26)25-15-13(2)7-8-14(18(3,4)5)16(25)20(11-23,12-24)19(15,9-21)10-22/h7-8,15-16H,6H2,1-5H3