(3,5-dinitrophenyl)-[4-(furan-2-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: (3,5-dinitrophenyl)-[4-(furan-2-ylmethyl)piperazin-1-yl]methanone Openeye Name: (3,5-dinitrophenyl)-[4-(2-furylmethyl)piperazin-1-yl]methanone CAS Name: (3,5-dinitrophenyl)-[4-(2-furanylmethyl)-1-piperazinyl]methanone IUPAC Name: (3,5-dinitrophenyl)-[4-(furan-2-ylmethyl)piperazin-1-yl]methanone Traditional Name: (3,5-dinitrophenyl)-[4-(2-furfuryl)piperazino]methanone Formula: C16H16N4O6 MolecularWeight: 360.32144

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CO2)C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CO2)C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O6/c21-16(12-8-13(19(22)23)10-14(9-12)20(24)25)18-5-3-17(4-6-18)11-15-2-1-7-26-15/h1-2,7-10H,3-6,11H2