ethyl 1-[(3-chlorophenyl)-[1-(furan-2-ylmethyl)-6-methyl-2-oxidanyl-4-oxidanylidene-pyridin-3-yl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(3-chlorophenyl)-[1-(furan-2-ylmethyl)-6-methyl-2-oxidanyl-4-oxidanylidene-pyridin-3-yl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(3-chlorophenyl)-[1-(2-furylmethyl)-2-hydroxy-6-methyl-4-oxo-3-pyridyl]methyl]piperidine-4-carboxylate CAS Name: 1-[(3-chlorophenyl)-[1-(2-furanylmethyl)-2-hydroxy-6-methyl-4-oxo-3-pyridinyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(3-chlorophenyl)-[1-(furan-2-ylmethyl)-2-hydroxy-6-methyl-4-oxopyridin-3-yl]methyl]piperidine-4-carboxylate Traditional Name: 1-[(3-chlorophenyl)-[1-(2-furfuryl)-2-hydroxy-4-keto-6-methyl-3-pyridyl]methyl]isonipecotic acid ethyl ester Formula: C26H29ClN2O5 MolecularWeight: 484.97186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(C2=CC(=CC=C2)Cl)C3=C(N(C(=CC3=O)C)CC4=CC=CO4)O

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(C2=CC(=CC=C2)Cl)C3=C(N(C(=CC3=O)C)CC4=CC=CO4)O

InChI

InChI=1S/C26H29ClN2O5/c1-3-33-26(32)18-9-11-28(12-10-18)24(19-6-4-7-20(27)15-19)23-22(30)14-17(2)29(25(23)31)16-21-8-5-13-34-21/h4-8,13-15,18,24,31H,3,9-12,16H2,1-2H3