[4-[6-(4-ethylpiperazin-1-yl)pyridazin-3-yl]piperazin-1-yl]-(2-nitrophenyl)methanone

Systemtic Name: [4-[6-(4-ethylpiperazin-1-yl)pyridazin-3-yl]piperazin-1-yl]-(2-nitrophenyl)methanone Openeye Name: [4-[6-(4-ethylpiperazin-1-yl)pyridazin-3-yl]piperazin-1-yl]-(2-nitrophenyl)methanone CAS Name: [4-[6-(4-ethyl-1-piperazinyl)-3-pyridazinyl]-1-piperazinyl]-(2-nitrophenyl)methanone IUPAC Name: [4-[6-(4-ethylpiperazin-1-yl)pyridazin-3-yl]piperazin-1-yl]-(2-nitrophenyl)methanone Traditional Name: [4-[6-(4-ethylpiperazino)pyridazin-3-yl]piperazino]-(2-nitrophenyl)methanone Formula: C21H27N7O3 MolecularWeight: 425.48418

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CCN1CCN(CC1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H27N7O3/c1-2-24-9-11-25(12-10-24)19-7-8-20(23-22-19)26-13-15-27(16-14-26)21(29)17-5-3-4-6-18(17)28(30)31/h3-8H,2,9-16H2,1H3