(phenylmethyl) 3-(hydroxymethyl)-4-[3-(6-methoxyquinolin-4-yl)propyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 3-(hydroxymethyl)-4-[3-(6-methoxyquinolin-4-yl)propyl]piperidine-1-carboxylate Openeye Name: benzyl 3-(hydroxymethyl)-4-[3-(6-methoxy-4-quinolyl)propyl]piperidine-1-carboxylate CAS Name: 3-(hydroxymethyl)-4-[3-(6-methoxy-4-quinolinyl)propyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(hydroxymethyl)-4-[3-(6-methoxyquinolin-4-yl)propyl]piperidine-1-carboxylate Traditional Name: 4-[3-(6-methoxy-4-quinolyl)propyl]-3-methylol-piperidine-1-carboxylic acid benzyl ester Formula: C27H32N2O4 MolecularWeight: 448.55398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)CCCC3CCN(CC3CO)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)CCCC3CCN(CC3CO)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C27H32N2O4/c1-32-24-10-11-26-25(16-24)22(12-14-28-26)9-5-8-21-13-15-29(17-23(21)18-30)27(31)33-19-20-6-3-2-4-7-20/h2-4,6-7,10-12,14,16,21,23,30H,5,8-9,13,15,17-19H2,1H3