diethyl 2-azanyl-3-cyano-4,6-bis(3-cyanophenyl)-4-methyl-cyclohexa-1,5-diene-1,3-dicarboxylate

Systemtic Name: diethyl 2-azanyl-3-cyano-4,6-bis(3-cyanophenyl)-4-methyl-cyclohexa-1,5-diene-1,3-dicarboxylate Openeye Name: diethyl 2-amino-3-cyano-4,6-bis(3-cyanophenyl)-4-methyl-cyclohexa-1,5-diene-1,3-dicarboxylate CAS Name: 2-amino-3-cyano-4,6-bis(3-cyanophenyl)-4-methylcyclohexa-1,5-diene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-amino-3-cyano-4,6-bis(3-cyanophenyl)-4-methylcyclohexa-1,5-diene-1,3-dicarboxylate Traditional Name: 2-amino-3-cyano-4,6-bis(3-cyanophenyl)-4-methyl-cyclohexa-1,5-diene-1,3-dicarboxylic acid diethyl ester Formula: C28H24N4O4 MolecularWeight: 480.51456

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(C(C=C1C2=CC=CC(=C2)C#N)(C)C3=CC=CC(=C3)C#N)(C#N)C(=O)OCC)N

Isomeric SMILES

CCOC(=O)C1=C(C(C(C=C1C2=CC=CC(=C2)C#N)(C)C3=CC=CC(=C3)C#N)(C#N)C(=O)OCC)N

InChI

InChI=1S/C28H24N4O4/c1-4-35-25(33)23-22(20-10-6-8-18(12-20)15-29)14-27(3,21-11-7-9-19(13-21)16-30)28(17-31,24(23)32)26(34)36-5-2/h6-14H,4-5,32H2,1-3H3