ethyl 8-chloranyl-4-(3-morpholin-4-ium-4-ylpropylamino)quinoline-3-carboxylate chloride

Systemtic Name: ethyl 8-chloranyl-4-(3-morpholin-4-ium-4-ylpropylamino)quinoline-3-carboxylate chloride Openeye Name: ethyl 8-chloro-4-(3-morpholin-4-ium-4-ylpropylamino)quinoline-3-carboxylate chloride CAS Name: 8-chloro-4-[3-(4-morpholin-4-iumyl)propylamino]-3-quinolinecarboxylic acid ethyl ester chloride IUPAC Name: ethyl 8-chloro-4-(3-morpholin-4-ium-4-ylpropylamino)quinoline-3-carboxylate chloride Traditional Name: 8-chloro-4-(3-morpholin-4-ium-4-ylpropylamino)quinoline-3-carboxylic acid ethyl ester chloride Formula: C19H25Cl2N3O3 MolecularWeight: 414.3261

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1NCCC[NH+]3CCOCC3)C=CC=C2Cl.[Cl-]

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1NCCC[NH+]3CCOCC3)C=CC=C2Cl.[Cl-]

InChI

InChI=1S/C19H24ClN3O3.ClH/c1-2-26-19(24)15-13-22-18-14(5-3-6-16(18)20)17(15)21-7-4-8-23-9-11-25-12-10-23;/h3,5-6,13H,2,4,7-12H2,1H3,(H,21,22);1H