ethyl 6-chloranyl-2-(morpholin-4-ium-4-ylmethyl)-4-phenyl-quinoline-3-carboxylate

Systemtic Name: ethyl 6-chloranyl-2-(morpholin-4-ium-4-ylmethyl)-4-phenyl-quinoline-3-carboxylate Openeye Name: ethyl 6-chloro-2-(morpholin-4-ium-4-ylmethyl)-4-phenyl-quinoline-3-carboxylate CAS Name: 6-chloro-2-(4-morpholin-4-iumylmethyl)-4-phenyl-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-2-(morpholin-4-ium-4-ylmethyl)-4-phenylquinoline-3-carboxylate Traditional Name: 6-chloro-2-(morpholin-4-ium-4-ylmethyl)-4-phenyl-quinoline-3-carboxylic acid ethyl ester Formula: C23H24ClN2O3+ MolecularWeight: 411.90126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2C=CC(=CC2=C1C3=CC=CC=C3)Cl)C[NH+]4CCOCC4

Isomeric SMILES

CCOC(=O)C1=C(N=C2C=CC(=CC2=C1C3=CC=CC=C3)Cl)C[NH+]4CCOCC4

InChI

InChI=1S/C23H23ClN2O3/c1-2-29-23(27)22-20(15-26-10-12-28-13-11-26)25-19-9-8-17(24)14-18(19)21(22)16-6-4-3-5-7-16/h3-9,14H,2,10-13,15H2,1H3/p+1