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

Systemtic Name: 1,3-benzodioxol-5-yl-[4-(2,4-dinitrophenyl)piperazin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[4-(2,4-dinitrophenyl)piperazin-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[4-(2,4-dinitrophenyl)-1-piperazinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[4-(2,4-dinitrophenyl)piperazin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[4-(2,4-dinitrophenyl)piperazino]methanone Formula: C18H16N4O7 MolecularWeight: 400.34224

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H16N4O7/c23-18(12-1-4-16-17(9-12)29-11-28-16)20-7-5-19(6-8-20)14-3-2-13(21(24)25)10-15(14)22(26)27/h1-4,9-10H,5-8,11H2