ethyl 4-[3-(3-chloranyl-6-methoxy-quinolin-4-yl)propyl]piperidine-4-carboxylate dihydrochloride

Systemtic Name: ethyl 4-[3-(3-chloranyl-6-methoxy-quinolin-4-yl)propyl]piperidine-4-carboxylate dihydrochloride Openeye Name: ethyl 4-[3-(3-chloro-6-methoxy-4-quinolyl)propyl]piperidine-4-carboxylate dihydrochloride CAS Name: 4-[3-(3-chloro-6-methoxy-4-quinolinyl)propyl]-4-piperidinecarboxylic acid ethyl ester dihydrochloride IUPAC Name: ethyl 4-[3-(3-chloro-6-methoxyquinolin-4-yl)propyl]piperidine-4-carboxylate dihydrochloride Traditional Name: 4-[3-(3-chloro-6-methoxy-4-quinolyl)propyl]isonipecotic acid ethyl ester dihydrochloride Formula: C21H29Cl3N2O3 MolecularWeight: 463.82556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCNCC1)CCCC2=C3C=C(C=CC3=NC=C2Cl)OC.Cl.Cl

Isomeric SMILES

CCOC(=O)C1(CCNCC1)CCCC2=C3C=C(C=CC3=NC=C2Cl)OC.Cl.Cl

InChI

InChI=1S/C21H27ClN2O3.2ClH/c1-3-27-20(25)21(9-11-23-12-10-21)8-4-5-16-17-13-15(26-2)6-7-19(17)24-14-18(16)22;;/h6-7,13-14,23H,3-5,8-12H2,1-2H3;2*1H