ethyl 1-(2,5-dimethylfuran-3-yl)carbonyl-4-[[(2R)-oxan-2-yl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-(2,5-dimethylfuran-3-yl)carbonyl-4-[[(2R)-oxan-2-yl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-(2,5-dimethylfuran-3-carbonyl)-4-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-4-carboxylate CAS Name: 1-[(2,5-dimethyl-3-furanyl)-oxomethyl]-4-[[(2R)-2-oxanyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2,5-dimethylfuran-3-carbonyl)-4-[[(2R)-oxan-2-yl]methyl]piperidine-4-carboxylate Traditional Name: 1-(2,5-dimethyl-3-furoyl)-4-[[(2R)-tetrahydropyran-2-yl]methyl]isonipecotic acid ethyl ester Formula: C21H31NO5 MolecularWeight: 377.47454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)C2=C(OC(=C2)C)C)CC3CCCCO3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)C2=C(OC(=C2)C)C)C[C@H]3CCCCO3

InChI

InChI=1S/C21H31NO5/c1-4-25-20(24)21(14-17-7-5-6-12-26-17)8-10-22(11-9-21)19(23)18-13-15(2)27-16(18)3/h13,17H,4-12,14H2,1-3H3/t17-/m1/s1