ethyl 7,8-bis(chloranyl)-4-[(4-morpholin-4-ylphenyl)amino]quinoline-3-carboxylate

Systemtic Name: ethyl 7,8-bis(chloranyl)-4-[(4-morpholin-4-ylphenyl)amino]quinoline-3-carboxylate Openeye Name: ethyl 7,8-dichloro-4-(4-morpholinoanilino)quinoline-3-carboxylate CAS Name: 7,8-dichloro-4-[4-(4-morpholinyl)anilino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 7,8-dichloro-4-(4-morpholin-4-ylanilino)quinoline-3-carboxylate Traditional Name: 7,8-dichloro-4-(4-morpholinoanilino)quinoline-3-carboxylic acid ethyl ester Formula: C22H21Cl2N3O3 MolecularWeight: 446.32644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1NC3=CC=C(C=C3)N4CCOCC4)C=CC(=C2Cl)Cl

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1NC3=CC=C(C=C3)N4CCOCC4)C=CC(=C2Cl)Cl

InChI

InChI=1S/C22H21Cl2N3O3/c1-2-30-22(28)17-13-25-21-16(7-8-18(23)19(21)24)20(17)26-14-3-5-15(6-4-14)27-9-11-29-12-10-27/h3-8,13H,2,9-12H2,1H3,(H,25,26)