ethyl 1-[(S)-(5-chloranyl-8-oxidanyl-quinolin-7-yl)-pyridin-2-yl-methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(S)-(5-chloranyl-8-oxidanyl-quinolin-7-yl)-pyridin-2-yl-methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(S)-(5-chloro-8-hydroxy-7-quinolyl)-(2-pyridyl)methyl]piperidine-4-carboxylate CAS Name: 1-[(S)-(5-chloro-8-hydroxy-7-quinolinyl)-(2-pyridinyl)methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(S)-(5-chloro-8-hydroxyquinolin-7-yl)-pyridin-2-ylmethyl]piperidine-4-carboxylate Traditional Name: 1-[(S)-(5-chloro-8-hydroxy-7-quinolyl)-(2-pyridyl)methyl]isonipecotic acid ethyl ester Formula: C23H24ClN3O3 MolecularWeight: 425.90796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(C2=CC=CC=N2)C3=CC(=C4C=CC=NC4=C3O)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)[C@H](C2=CC=CC=N2)C3=CC(=C4C=CC=NC4=C3O)Cl

InChI

InChI=1S/C23H24ClN3O3/c1-2-30-23(29)15-8-12-27(13-9-15)21(19-7-3-4-10-25-19)17-14-18(24)16-6-5-11-26-20(16)22(17)28/h3-7,10-11,14-15,21,28H,2,8-9,12-13H2,1H3/t21-/m0/s1