2-(furan-2-yl)-5-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazin-1-yl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-(furan-2-yl)-5-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazin-1-yl]-1,3-oxazole-4-carbonitrile Openeye Name: 2-(2-furyl)-5-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazin-1-yl]oxazole-4-carbonitrile CAS Name: 2-(2-furanyl)-5-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-1-piperazinyl]-4-oxazolecarbonitrile IUPAC Name: 2-(furan-2-yl)-5-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazin-1-yl]-1,3-oxazole-4-carbonitrile Traditional Name: 2-(2-furyl)-5-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazino]oxazole-4-carbonitrile Formula: C21H19N5O6 MolecularWeight: 437.40546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3)C4=C(N=C(O4)C5=CC=CO5)C#N

Isomeric SMILES

C1CN(CCN1CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3)C4=C(N=C(O4)C5=CC=CO5)C#N

InChI

InChI=1S/C21H19N5O6/c22-10-17-21(32-20(23-17)18-2-1-7-30-18)25-5-3-24(4-6-25)11-14-8-16(26(27)28)9-15-12-29-13-31-19(14)15/h1-2,7-9H,3-6,11-13H2