tetraethyl 3-azanyl-4-cyano-5-methyl-cyclohexa-2,6-diene-1,2,4,5-tetracarboxylate

Systemtic Name: tetraethyl 3-azanyl-4-cyano-5-methyl-cyclohexa-2,6-diene-1,2,4,5-tetracarboxylate Openeye Name: tetraethyl 3-amino-4-cyano-5-methyl-cyclohexa-2,6-diene-1,2,4,5-tetracarboxylate CAS Name: 3-amino-4-cyano-5-methylcyclohexa-2,6-diene-1,2,4,5-tetracarboxylic acid tetraethyl ester IUPAC Name: tetraethyl 3-amino-4-cyano-5-methylcyclohexa-2,6-diene-1,2,4,5-tetracarboxylate Traditional Name: 3-amino-4-cyano-5-methyl-cyclohexa-2,6-diene-1,2,4,5-tetracarboxylic acid tetraethyl ester Formula: C20H26N2O8 MolecularWeight: 422.42904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O8/c1-6-27-15(23)12-10-19(5,17(25)29-8-3)20(11-21,18(26)30-9-4)14(22)13(12)16(24)28-7-2/h10H,6-9,22H2,1-5H3