4-[(5-chloranyl-2-methoxy-phenyl)amino]-8-morpholin-4-yl-quinoline-3-carboxylic acid

Systemtic Name: 4-[(5-chloranyl-2-methoxy-phenyl)amino]-8-morpholin-4-yl-quinoline-3-carboxylic acid Openeye Name: 4-(5-chloro-2-methoxy-anilino)-8-morpholino-quinoline-3-carboxylic acid CAS Name: 4-(5-chloro-2-methoxyanilino)-8-(4-morpholinyl)-3-quinolinecarboxylic acid IUPAC Name: 4-(5-chloro-2-methoxyanilino)-8-morpholin-4-ylquinoline-3-carboxylic acid Traditional Name: 4-(5-chloro-2-methoxy-anilino)-8-morpholino-quinoline-3-carboxylic acid Formula: C21H20ClN3O4 MolecularWeight: 413.8542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC2=C3C=CC=C(C3=NC=C2C(=O)O)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC2=C3C=CC=C(C3=NC=C2C(=O)O)N4CCOCC4

InChI

InChI=1S/C21H20ClN3O4/c1-28-18-6-5-13(22)11-16(18)24-19-14-3-2-4-17(25-7-9-29-10-8-25)20(14)23-12-15(19)21(26)27/h2-6,11-12H,7-10H2,1H3,(H,23,24)(H,26,27)