3-(6-methoxyquinolin-4-yl)propyl 1-(3-phenylprop-2-ynyl)piperidine-3-carboxylate

Systemtic Name: 3-(6-methoxyquinolin-4-yl)propyl 1-(3-phenylprop-2-ynyl)piperidine-3-carboxylate Openeye Name: 3-(6-methoxy-4-quinolyl)propyl 1-(3-phenylprop-2-ynyl)piperidine-3-carboxylate CAS Name: 1-(3-phenylprop-2-ynyl)-3-piperidinecarboxylic acid 3-(6-methoxy-4-quinolinyl)propyl ester IUPAC Name: 3-(6-methoxyquinolin-4-yl)propyl 1-(3-phenylprop-2-ynyl)piperidine-3-carboxylate Traditional Name: 1-(3-phenylprop-2-ynyl)nipecotic acid 3-(6-methoxy-4-quinolyl)propyl ester Formula: C28H30N2O3 MolecularWeight: 442.5494

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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

Isomeric SMILES

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

InChI

InChI=1S/C28H30N2O3/c1-32-25-13-14-27-26(20-25)23(15-16-29-27)12-7-19-33-28(31)24-11-6-18-30(21-24)17-5-10-22-8-3-2-4-9-22/h2-4,8-9,13-16,20,24H,6-7,11-12,17-19,21H2,1H3