ethyl 6-chloranyl-8-methyl-4-[(4-morpholin-4-ium-4-ylphenyl)amino]quinoline-3-carboxylate

Systemtic Name: ethyl 6-chloranyl-8-methyl-4-[(4-morpholin-4-ium-4-ylphenyl)amino]quinoline-3-carboxylate Openeye Name: ethyl 6-chloro-8-methyl-4-(4-morpholin-4-ium-4-ylanilino)quinoline-3-carboxylate CAS Name: 6-chloro-8-methyl-4-[4-(4-morpholin-4-iumyl)anilino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-8-methyl-4-(4-morpholin-4-ium-4-ylanilino)quinoline-3-carboxylate Traditional Name: 6-chloro-8-methyl-4-(4-morpholin-4-ium-4-ylanilino)quinoline-3-carboxylic acid ethyl ester Formula: C23H25ClN3O3+ MolecularWeight: 426.9159

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=CC(=C2N=C1)C)Cl)NC3=CC=C(C=C3)[NH+]4CCOCC4

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=CC(=C2N=C1)C)Cl)NC3=CC=C(C=C3)[NH+]4CCOCC4

InChI

InChI=1S/C23H24ClN3O3/c1-3-30-23(28)20-14-25-21-15(2)12-16(24)13-19(21)22(20)26-17-4-6-18(7-5-17)27-8-10-29-11-9-27/h4-7,12-14H,3,8-11H2,1-2H3,(H,25,26)/p+1