N-[4-[[4-(furan-2-ylmethyl)piperazin-1-yl]methyl]phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-[[4-(furan-2-ylmethyl)piperazin-1-yl]methyl]phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-[[4-(2-furylmethyl)piperazin-1-yl]methyl]phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-[[4-(2-furanylmethyl)-1-piperazinyl]methyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-[[4-(furan-2-ylmethyl)piperazin-1-yl]methyl]phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-[[4-(2-furfuryl)piperazino]methyl]phenyl]-piperonylamide Formula: C24H25N3O4 MolecularWeight: 419.473

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4)CC5=CC=CO5

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4)CC5=CC=CO5

InChI

InChI=1S/C24H25N3O4/c28-24(19-5-8-22-23(14-19)31-17-30-22)25-20-6-3-18(4-7-20)15-26-9-11-27(12-10-26)16-21-2-1-13-29-21/h1-8,13-14H,9-12,15-17H2,(H,25,28)