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

Systemtic Name: ethyl 7,7,8,8-tetracyano-2-methyl-5-propan-2-yl-9-azabicyclo[4.2.1]nona-2,4-diene-9-carboxylate Openeye Name: ethyl 7,7,8,8-tetracyano-5-isopropyl-2-methyl-9-azabicyclo[4.2.1]nona-2,4-diene-9-carboxylate CAS Name: 7,7,8,8-tetracyano-2-methyl-5-propan-2-yl-9-azabicyclo[4.2.1]nona-2,4-diene-9-carboxylic acid ethyl ester IUPAC Name: ethyl 7,7,8,8-tetracyano-2-methyl-5-propan-2-yl-9-azabicyclo[4.2.1]nona-2,4-diene-9-carboxylate Traditional Name: 7,7,8,8-tetracyano-5-isopropyl-2-methyl-9-azabicyclo[4.2.1]nona-2,4-diene-9-carboxylic acid ethyl ester Formula: C19H19N5O2 MolecularWeight: 349.38646

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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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N5O2/c1-5-26-17(25)24-15-13(4)6-7-14(12(2)3)16(24)19(10-22,11-23)18(15,8-20)9-21/h6-7,12,15-16H,5H2,1-4H3