N-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]-4-fluoranyl-benzamide Openeye Name: N-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-4-fluoro-benzamide CAS Name: N-[4-[1,3-benzodioxol-5-yl(oxo)methyl]-1-piperazinyl]-4-fluorobenzamide IUPAC Name: N-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-4-fluorobenzamide Traditional Name: 4-fluoro-N-(4-piperonyloylpiperazino)benzamide Formula: C19H18FN3O4 MolecularWeight: 371.362323

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18FN3O4/c20-15-4-1-13(2-5-15)18(24)21-23-9-7-22(8-10-23)19(25)14-3-6-16-17(11-14)27-12-26-16/h1-6,11H,7-10,12H2,(H,21,24)