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

Systemtic Name: methyl 4-[3-(3-chloranyl-6-methoxy-quinolin-4-yl)-3-oxidanyl-propyl]piperidine-3-carboxylate Openeye Name: methyl 4-[3-(3-chloro-6-methoxy-4-quinolyl)-3-hydroxy-propyl]piperidine-3-carboxylate CAS Name: 4-[3-(3-chloro-6-methoxy-4-quinolinyl)-3-hydroxypropyl]-3-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[3-(3-chloro-6-methoxyquinolin-4-yl)-3-hydroxypropyl]piperidine-3-carboxylate Traditional Name: 4-[3-(3-chloro-6-methoxy-4-quinolyl)-3-hydroxy-propyl]nipecotic acid methyl ester Formula: C20H25ClN2O4 MolecularWeight: 392.8765

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C(=CN=C2C=C1)Cl)C(CCC3CCNCC3C(=O)OC)O

Isomeric SMILES

COC1=CC2=C(C(=CN=C2C=C1)Cl)C(CCC3CCNCC3C(=O)OC)O

InChI

InChI=1S/C20H25ClN2O4/c1-26-13-4-5-17-14(9-13)19(16(21)11-23-17)18(24)6-3-12-7-8-22-10-15(12)20(25)27-2/h4-5,9,11-12,15,18,22,24H,3,6-8,10H2,1-2H3