ethyl 1-[[3-(1,3-benzodioxol-5-ylmethyl)-1,2-oxazol-5-yl]carbonyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[3-(1,3-benzodioxol-5-ylmethyl)-1,2-oxazol-5-yl]carbonyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-(1,3-benzodioxol-5-ylmethyl)isoxazole-5-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[3-(1,3-benzodioxol-5-ylmethyl)-5-isoxazolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(1,3-benzodioxol-5-ylmethyl)-1,2-oxazole-5-carbonyl]piperidine-4-carboxylate Traditional Name: 1-(3-piperonylisoxazole-5-carbonyl)isonipecotic acid ethyl ester Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=NO2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=NO2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H22N2O6/c1-2-25-20(24)14-5-7-22(8-6-14)19(23)18-11-15(21-28-18)9-13-3-4-16-17(10-13)27-12-26-16/h3-4,10-11,14H,2,5-9,12H2,1H3