ethyl 6-bromanyl-4-[(4-morpholin-4-ylphenyl)amino]quinoline-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-4-[(4-morpholin-4-ylphenyl)amino]quinoline-3-carboxylate Openeye Name: ethyl 6-bromo-4-(4-morpholinoanilino)quinoline-3-carboxylate CAS Name: 6-bromo-4-[4-(4-morpholinyl)anilino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-4-(4-morpholin-4-ylanilino)quinoline-3-carboxylate Traditional Name: 6-bromo-4-(4-morpholinoanilino)quinoline-3-carboxylic acid ethyl ester Formula: C22H22BrN3O3 MolecularWeight: 456.33238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NC3=CC=C(C=C3)N4CCOCC4)Br

Isomeric SMILES

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NC3=CC=C(C=C3)N4CCOCC4)Br

InChI

InChI=1S/C22H22BrN3O3/c1-2-29-22(27)19-14-24-20-8-3-15(23)13-18(20)21(19)25-16-4-6-17(7-5-16)26-9-11-28-12-10-26/h3-8,13-14H,2,9-12H2,1H3,(H,24,25)