diethyl 5-azanyl-4,4,6-tricyano-3-methyl-cyclohexa-1,5-diene-1,3-dicarboxylate

Systemtic Name: diethyl 5-azanyl-4,4,6-tricyano-3-methyl-cyclohexa-1,5-diene-1,3-dicarboxylate Openeye Name: diethyl 5-amino-4,4,6-tricyano-3-methyl-cyclohexa-1,5-diene-1,3-dicarboxylate CAS Name: 5-amino-4,4,6-tricyano-3-methylcyclohexa-1,5-diene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-amino-4,4,6-tricyano-3-methylcyclohexa-1,5-diene-1,3-dicarboxylate Traditional Name: 5-amino-4,4,6-tricyano-3-methyl-cyclohexa-1,5-diene-1,3-dicarboxylic acid diethyl ester Formula: C16H16N4O4 MolecularWeight: 328.32264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(C(C(=C1C#N)N)(C#N)C#N)(C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(C(C(=C1C#N)N)(C#N)C#N)(C)C(=O)OCC

InChI

InChI=1S/C16H16N4O4/c1-4-23-13(21)10-6-15(3,14(22)24-5-2)16(8-18,9-19)12(20)11(10)7-17/h6H,4-5,20H2,1-3H3