methyl (3R,4R)-4-[3-(6-methoxyquinolin-3-yl)-3-oxidanylidene-propyl]piperidine-3-carboxylate

Systemtic Name: methyl (3R,4R)-4-[3-(6-methoxyquinolin-3-yl)-3-oxidanylidene-propyl]piperidine-3-carboxylate Openeye Name: methyl (3R,4R)-4-[3-(6-methoxy-3-quinolyl)-3-oxo-propyl]piperidine-3-carboxylate CAS Name: (3R,4R)-4-[3-(6-methoxy-3-quinolinyl)-3-oxopropyl]-3-piperidinecarboxylic acid methyl ester IUPAC Name: methyl (3R,4R)-4-[3-(6-methoxyquinolin-3-yl)-3-oxopropyl]piperidine-3-carboxylate Traditional Name: (3R,4R)-4-[3-keto-3-(6-methoxy-3-quinolyl)propyl]nipecotic acid methyl ester Formula: C20H24N2O4 MolecularWeight: 356.41556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=CC2=CC(=CN=C2C=C1)C(=O)CC[C@@H]3CCNC[C@@H]3C(=O)OC

InChI

InChI=1S/C20H24N2O4/c1-25-16-4-5-18-14(10-16)9-15(11-22-18)19(23)6-3-13-7-8-21-12-17(13)20(24)26-2/h4-5,9-11,13,17,21H,3,6-8,12H2,1-2H3/t13-,17+/m1/s1