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

Systemtic Name: N-[2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-(4-benzoylpiperazin-1-yl)-2-oxo-ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-(4-benzoyl-1-piperazinyl)-2-oxoethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-(4-benzoylpiperazin-1-yl)-2-oxoethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-(4-benzoylpiperazino)-2-keto-ethyl]-piperonylamide Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CNC(=O)C2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CNC(=O)C2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O5/c25-19(13-22-20(26)16-6-7-17-18(12-16)29-14-28-17)23-8-10-24(11-9-23)21(27)15-4-2-1-3-5-15/h1-7,12H,8-11,13-14H2,(H,22,26)