ethyl 1-[[7-[(4-ethoxycarbonylpiperidin-1-yl)methyl]-8-oxidanyl-quinolin-5-yl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[7-[(4-ethoxycarbonylpiperidin-1-yl)methyl]-8-oxidanyl-quinolin-5-yl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[[7-[(4-ethoxycarbonyl-1-piperidyl)methyl]-8-hydroxy-5-quinolyl]methyl]piperidine-4-carboxylate CAS Name: 1-[[7-[(4-ethoxycarbonyl-1-piperidinyl)methyl]-8-hydroxy-5-quinolinyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[7-[(4-ethoxycarbonylpiperidin-1-yl)methyl]-8-hydroxyquinolin-5-yl]methyl]piperidine-4-carboxylate Traditional Name: 1-[[7-[(4-carbethoxypiperidino)methyl]-8-hydroxy-5-quinolyl]methyl]isonipecotic acid ethyl ester Formula: C27H37N3O5 MolecularWeight: 483.59978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CC2=CC(=C(C3=C2C=CC=N3)O)CN4CCC(CC4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CC2=CC(=C(C3=C2C=CC=N3)O)CN4CCC(CC4)C(=O)OCC

InChI

InChI=1S/C27H37N3O5/c1-3-34-26(32)19-7-12-29(13-8-19)17-21-16-22(25(31)24-23(21)6-5-11-28-24)18-30-14-9-20(10-15-30)27(33)35-4-2/h5-6,11,16,19-20,31H,3-4,7-10,12-15,17-18H2,1-2H3