(3,5-dinitrophenyl)-[4-[6-(4-ethylphenyl)pyridazin-3-yl]piperazin-1-yl]methanone

Systemtic Name: (3,5-dinitrophenyl)-[4-[6-(4-ethylphenyl)pyridazin-3-yl]piperazin-1-yl]methanone Openeye Name: (3,5-dinitrophenyl)-[4-[6-(4-ethylphenyl)pyridazin-3-yl]piperazin-1-yl]methanone CAS Name: (3,5-dinitrophenyl)-[4-[6-(4-ethylphenyl)-3-pyridazinyl]-1-piperazinyl]methanone IUPAC Name: (3,5-dinitrophenyl)-[4-[6-(4-ethylphenyl)pyridazin-3-yl]piperazin-1-yl]methanone Traditional Name: (3,5-dinitrophenyl)-[4-[6-(4-ethylphenyl)pyridazin-3-yl]piperazino]methanone Formula: C23H22N6O5 MolecularWeight: 462.45798

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H22N6O5/c1-2-16-3-5-17(6-4-16)21-7-8-22(25-24-21)26-9-11-27(12-10-26)23(30)18-13-19(28(31)32)15-20(14-18)29(33)34/h3-8,13-15H,2,9-12H2,1H3