diethyl 4-[(4-cyanophenyl)amino]quinoline-3,6-dicarboxylate

Systemtic Name: diethyl 4-[(4-cyanophenyl)amino]quinoline-3,6-dicarboxylate Openeye Name: diethyl 4-(4-cyanoanilino)quinoline-3,6-dicarboxylate CAS Name: 4-(4-cyanoanilino)quinoline-3,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-(4-cyanoanilino)quinoline-3,6-dicarboxylate Traditional Name: 4-(4-cyanoanilino)quinoline-3,6-dicarboxylic acid diethyl ester Formula: C22H19N3O4 MolecularWeight: 389.40396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CCOC(=O)C1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H19N3O4/c1-3-28-21(26)15-7-10-19-17(11-15)20(18(13-24-19)22(27)29-4-2)25-16-8-5-14(12-23)6-9-16/h5-11,13H,3-4H2,1-2H3,(H,24,25)