3-(6-methoxyquinolin-4-yl)propyl 1-[3-(3-fluorophenyl)prop-2-ynyl]piperidine-3-carboxylate

Systemtic Name: 3-(6-methoxyquinolin-4-yl)propyl 1-[3-(3-fluorophenyl)prop-2-ynyl]piperidine-3-carboxylate Openeye Name: 3-(6-methoxy-4-quinolyl)propyl 1-[3-(3-fluorophenyl)prop-2-ynyl]piperidine-3-carboxylate CAS Name: 1-[3-(3-fluorophenyl)prop-2-ynyl]-3-piperidinecarboxylic acid 3-(6-methoxy-4-quinolinyl)propyl ester IUPAC Name: 3-(6-methoxyquinolin-4-yl)propyl 1-[3-(3-fluorophenyl)prop-2-ynyl]piperidine-3-carboxylate Traditional Name: 1-[3-(3-fluorophenyl)prop-2-ynyl]nipecotic acid 3-(6-methoxy-4-quinolyl)propyl ester Formula: C28H29FN2O3 MolecularWeight: 460.539863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)CCCOC(=O)C3CCCN(C3)CC#CC4=CC(=CC=C4)F

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)CCCOC(=O)C3CCCN(C3)CC#CC4=CC(=CC=C4)F

InChI

InChI=1S/C28H29FN2O3/c1-33-25-11-12-27-26(19-25)22(13-14-30-27)9-5-17-34-28(32)23-8-4-16-31(20-23)15-3-7-21-6-2-10-24(29)18-21/h2,6,10-14,18-19,23H,4-5,8-9,15-17,20H2,1H3