dimethyl 2,5-bis[(2-cyanophenyl)amino]cyclohexa-1,4-diene-1,4-dicarboxylate

Systemtic Name: dimethyl 2,5-bis[(2-cyanophenyl)amino]cyclohexa-1,4-diene-1,4-dicarboxylate Openeye Name: dimethyl 2,5-bis(2-cyanoanilino)cyclohexa-1,4-diene-1,4-dicarboxylate CAS Name: 2,5-bis(2-cyanoanilino)cyclohexa-1,4-diene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2,5-bis(2-cyanoanilino)cyclohexa-1,4-diene-1,4-dicarboxylate Traditional Name: 2,5-bis(2-cyanoanilino)cyclohexa-1,4-diene-1,4-dicarboxylic acid dimethyl ester Formula: C24H20N4O4 MolecularWeight: 428.44

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(CC(=C(C1)NC2=CC=CC=C2C#N)C(=O)OC)NC3=CC=CC=C3C#N

Isomeric SMILES

COC(=O)C1=C(CC(=C(C1)NC2=CC=CC=C2C#N)C(=O)OC)NC3=CC=CC=C3C#N

InChI

InChI=1S/C24H20N4O4/c1-31-23(29)17-11-22(28-20-10-6-4-8-16(20)14-26)18(24(30)32-2)12-21(17)27-19-9-5-3-7-15(19)13-25/h3-10,27-28H,11-12H2,1-2H3