ethyl 2-methyl-4-[(4-morpholin-4-ium-4-ylphenyl)amino]quinoline-6-carboxylate chloride

Systemtic Name: ethyl 2-methyl-4-[(4-morpholin-4-ium-4-ylphenyl)amino]quinoline-6-carboxylate chloride Openeye Name: ethyl 2-methyl-4-(4-morpholin-4-ium-4-ylanilino)quinoline-6-carboxylate chloride CAS Name: 2-methyl-4-[4-(4-morpholin-4-iumyl)anilino]-6-quinolinecarboxylic acid ethyl ester chloride IUPAC Name: ethyl 2-methyl-4-(4-morpholin-4-ium-4-ylanilino)quinoline-6-carboxylate chloride Traditional Name: 2-methyl-4-(4-morpholin-4-ium-4-ylanilino)quinoline-6-carboxylic acid ethyl ester chloride Formula: C23H26ClN3O3 MolecularWeight: 427.92384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(C=C2NC3=CC=C(C=C3)[NH+]4CCOCC4)C.[Cl-]

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(C=C2NC3=CC=C(C=C3)[NH+]4CCOCC4)C.[Cl-]

InChI

InChI=1S/C23H25N3O3.ClH/c1-3-29-23(27)17-4-9-21-20(15-17)22(14-16(2)24-21)25-18-5-7-19(8-6-18)26-10-12-28-13-11-26;/h4-9,14-15H,3,10-13H2,1-2H3,(H,24,25);1H