N-[2-[4-[2-(4-nitrophenyl)ethanoyl]piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[4-[2-(4-nitrophenyl)ethanoyl]piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[4-[2-(4-nitrophenyl)acetyl]piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[4-[2-(4-nitrophenyl)-1-oxoethyl]-1-piperazinyl]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[4-[2-(4-nitrophenyl)acetyl]piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[4-[2-(4-nitrophenyl)acetyl]piperazino]ethyl]-piperonylamide Formula: C22H24N4O6 MolecularWeight: 440.44916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)C2=CC3=C(C=C2)OCO3)C(=O)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCNC(=O)C2=CC3=C(C=C2)OCO3)C(=O)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O6/c27-21(13-16-1-4-18(5-2-16)26(29)30)25-11-9-24(10-12-25)8-7-23-22(28)17-3-6-19-20(14-17)32-15-31-19/h1-6,14H,7-13,15H2,(H,23,28)