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

Systemtic Name: (phenylmethyl) 3-methanoyl-4-[3-(6-methoxyquinolin-4-yl)propyl]piperidine-1-carboxylate Openeye Name: benzyl 3-formyl-4-[3-(6-methoxy-4-quinolyl)propyl]piperidine-1-carboxylate CAS Name: 3-formyl-4-[3-(6-methoxy-4-quinolinyl)propyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-formyl-4-[3-(6-methoxyquinolin-4-yl)propyl]piperidine-1-carboxylate Traditional Name: 3-formyl-4-[3-(6-methoxy-4-quinolyl)propyl]piperidine-1-carboxylic acid benzyl ester Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)CCCC3CCN(CC3C=O)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)CCCC3CCN(CC3C=O)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C27H30N2O4/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/h2-4,6-7,10-12,14,16,18,21,23H,5,8-9,13,15,17,19H2,1H3