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

Systemtic Name: 4-[(5-chloranyl-2-oxidanyl-phenyl)amino]-8-morpholin-4-yl-quinoline-3-carboxylic acid hydrochloride Openeye Name: 4-(5-chloro-2-hydroxy-anilino)-8-morpholino-quinoline-3-carboxylic acid hydrochloride CAS Name: 4-(5-chloro-2-hydroxyanilino)-8-(4-morpholinyl)-3-quinolinecarboxylic acid hydrochloride IUPAC Name: 4-(5-chloro-2-hydroxyanilino)-8-morpholin-4-ylquinoline-3-carboxylic acid hydrochloride Traditional Name: 4-(5-chloro-2-hydroxy-anilino)-8-morpholino-quinoline-3-carboxylic acid hydrochloride Formula: C20H19Cl2N3O4 MolecularWeight: 436.28856

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=CC3=C(C(=CN=C32)C(=O)O)NC4=C(C=CC(=C4)Cl)O.Cl

Isomeric SMILES

C1COCCN1C2=CC=CC3=C(C(=CN=C32)C(=O)O)NC4=C(C=CC(=C4)Cl)O.Cl

InChI

InChI=1S/C20H18ClN3O4.ClH/c21-12-4-5-17(25)15(10-12)23-18-13-2-1-3-16(24-6-8-28-9-7-24)19(13)22-11-14(18)20(26)27;/h1-5,10-11,25H,6-9H2,(H,22,23)(H,26,27);1H