[4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-3-nitro-phenyl]-phenyl-methanone

Systemtic Name: [4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-3-nitro-phenyl]-phenyl-methanone Openeye Name: [4-[4-(furan-2-carbonyl)piperazin-1-yl]-3-nitro-phenyl]-phenyl-methanone CAS Name: [4-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-3-nitrophenyl]-phenylmethanone IUPAC Name: [4-[4-(furan-2-carbonyl)piperazin-1-yl]-3-nitrophenyl]-phenylmethanone Traditional Name: [4-[4-(2-furoyl)piperazino]-3-nitro-phenyl]-phenyl-methanone Formula: C22H19N3O5 MolecularWeight: 405.40336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19N3O5/c26-21(16-5-2-1-3-6-16)17-8-9-18(19(15-17)25(28)29)23-10-12-24(13-11-23)22(27)20-7-4-14-30-20/h1-9,14-15H,10-13H2