ethyl 1-[2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(1,3-benzodioxole-5-carbonylamino)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(1,3-benzodioxole-5-carbonylamino)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(piperonyloylamino)acetyl]isonipecotic acid ethyl ester Formula: C18H22N2O6 MolecularWeight: 362.37708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H22N2O6/c1-2-24-18(23)12-5-7-20(8-6-12)16(21)10-19-17(22)13-3-4-14-15(9-13)26-11-25-14/h3-4,9,12H,2,5-8,10-11H2,1H3,(H,19,22)