ethyl 3-azanylidene-4,7,7-tricyano-1,5-dimethyl-2-oxabicyclo[2.2.1]heptane-6-carboxylate

Systemtic Name: ethyl 3-azanylidene-4,7,7-tricyano-1,5-dimethyl-2-oxabicyclo[2.2.1]heptane-6-carboxylate Openeye Name: ethyl 4,7,7-tricyano-3-imino-1,5-dimethyl-2-oxabicyclo[2.2.1]heptane-6-carboxylate CAS Name: 4,7,7-tricyano-3-imino-1,5-dimethyl-2-oxabicyclo[2.2.1]heptane-6-carboxylic acid ethyl ester IUPAC Name: ethyl 4,7,7-tricyano-3-imino-1,5-dimethyl-2-oxabicyclo[2.2.1]heptane-6-carboxylate Traditional Name: 4,7,7-tricyano-3-imino-1,5-dimethyl-2-oxabicyclo[2.2.1]heptane-6-carboxylic acid ethyl ester Formula: C14H14N4O3 MolecularWeight: 286.28596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C2(C(=N)OC1(C2(C#N)C#N)C)C#N)C

Isomeric SMILES

CCOC(=O)C1C(C2(C(=N)OC1(C2(C#N)C#N)C)C#N)C

InChI

InChI=1S/C14H14N4O3/c1-4-20-10(19)9-8(2)14(7-17)11(18)21-12(9,3)13(14,5-15)6-16/h8-9,18H,4H2,1-3H3