2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-5-nitro-benzenecarbonitrile Openeye Name: 2-[4-(furan-2-carbonyl)piperazin-1-yl]-5-nitro-benzonitrile CAS Name: 2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-5-nitrobenzonitrile IUPAC Name: 2-[4-(furan-2-carbonyl)piperazin-1-yl]-5-nitrobenzonitrile Traditional Name: 2-[4-(2-furoyl)piperazino]-5-nitro-benzonitrile Formula: C16H14N4O4 MolecularWeight: 326.30676

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C#N)C(=O)C3=CC=CO3

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C#N)C(=O)C3=CC=CO3

InChI

InChI=1S/C16H14N4O4/c17-11-12-10-13(20(22)23)3-4-14(12)18-5-7-19(8-6-18)16(21)15-2-1-9-24-15/h1-4,9-10H,5-8H2