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

Systemtic Name: ethyl 4-[2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(1,3-benzodioxole-5-carbonylamino)acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(1,3-benzodioxole-5-carbonylamino)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(piperonyloylamino)acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H21N3O6 MolecularWeight: 363.36514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H21N3O6/c1-2-24-17(23)20-7-5-19(6-8-20)15(21)10-18-16(22)12-3-4-13-14(9-12)26-11-25-13/h3-4,9H,2,5-8,10-11H2,1H3,(H,18,22)