N-[4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]phenyl]-2-nitro-benzamide

Systemtic Name: N-[4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]phenyl]-2-nitro-benzamide Openeye Name: N-[4-[4-(furan-2-carbonyl)piperazin-1-yl]phenyl]-2-nitro-benzamide CAS Name: N-[4-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]phenyl]-2-nitrobenzamide IUPAC Name: N-[4-[4-(furan-2-carbonyl)piperazin-1-yl]phenyl]-2-nitrobenzamide Traditional Name: N-[4-[4-(2-furoyl)piperazino]phenyl]-2-nitro-benzamide Formula: C22H20N4O5 MolecularWeight: 420.418

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3[N+](=O)[O-])C(=O)C4=CC=CO4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3[N+](=O)[O-])C(=O)C4=CC=CO4

InChI

InChI=1S/C22H20N4O5/c27-21(18-4-1-2-5-19(18)26(29)30)23-16-7-9-17(10-8-16)24-11-13-25(14-12-24)22(28)20-6-3-15-31-20/h1-10,15H,11-14H2,(H,23,27)