ethyl 1-[7-chloranyl-3-[[(1-oxidanylcyclohexyl)methylamino]methyl]quinolin-2-yl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[7-chloranyl-3-[[(1-oxidanylcyclohexyl)methylamino]methyl]quinolin-2-yl]piperidine-3-carboxylate Openeye Name: ethyl 1-[7-chloro-3-[[(1-hydroxycyclohexyl)methylamino]methyl]-2-quinolyl]piperidine-3-carboxylate CAS Name: 1-[7-chloro-3-[[(1-hydroxycyclohexyl)methylamino]methyl]-2-quinolinyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[7-chloro-3-[[(1-hydroxycyclohexyl)methylamino]methyl]quinolin-2-yl]piperidine-3-carboxylate Traditional Name: 1-[7-chloro-3-[[(1-hydroxycyclohexyl)methylamino]methyl]-2-quinolyl]nipecotic acid ethyl ester Formula: C25H34ClN3O3 MolecularWeight: 460.00876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2=C(C=C3C=CC(=CC3=N2)Cl)CNCC4(CCCCC4)O

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C2=C(C=C3C=CC(=CC3=N2)Cl)CNCC4(CCCCC4)O

InChI

InChI=1S/C25H34ClN3O3/c1-2-32-24(30)19-7-6-12-29(16-19)23-20(13-18-8-9-21(26)14-22(18)28-23)15-27-17-25(31)10-4-3-5-11-25/h8-9,13-14,19,27,31H,2-7,10-12,15-17H2,1H3