N-[6-[4-(phenylcarbonyl)piperazin-1-yl]pyridin-3-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[6-[4-(phenylcarbonyl)piperazin-1-yl]pyridin-3-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[6-(4-benzoylpiperazin-1-yl)-3-pyridyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[6-(4-benzoyl-1-piperazinyl)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[6-(4-benzoylpiperazin-1-yl)pyridin-3-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[6-(4-benzoylpiperazino)-3-pyridyl]-piperonylamide Formula: C24H22N4O4 MolecularWeight: 430.45588

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C24H22N4O4/c29-23(18-6-8-20-21(14-18)32-16-31-20)26-19-7-9-22(25-15-19)27-10-12-28(13-11-27)24(30)17-4-2-1-3-5-17/h1-9,14-15H,10-13,16H2,(H,26,29)