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

Systemtic Name: (phenylmethyl) 4-[3-(3-chloranyl-6-methoxy-quinolin-4-yl)propyl]piperidine-4-carboxylate Openeye Name: benzyl 4-[3-(3-chloro-6-methoxy-4-quinolyl)propyl]piperidine-4-carboxylate CAS Name: 4-[3-(3-chloro-6-methoxy-4-quinolinyl)propyl]-4-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[3-(3-chloro-6-methoxyquinolin-4-yl)propyl]piperidine-4-carboxylate Traditional Name: 4-[3-(3-chloro-6-methoxy-4-quinolyl)propyl]isonipecotic acid benzyl ester Formula: C26H29ClN2O3 MolecularWeight: 452.97306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C(=CN=C2C=C1)Cl)CCCC3(CCNCC3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C(=CN=C2C=C1)Cl)CCCC3(CCNCC3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H29ClN2O3/c1-31-20-9-10-24-22(16-20)21(23(27)17-29-24)8-5-11-26(12-14-28-15-13-26)25(30)32-18-19-6-3-2-4-7-19/h2-4,6-7,9-10,16-17,28H,5,8,11-15,18H2,1H3