[2-(6-chloranylpyridazin-3-yl)-5-(4-nitrophenyl)pyrazol-3-yl] methanesulfonate

Systemtic Name: [2-(6-chloranylpyridazin-3-yl)-5-(4-nitrophenyl)pyrazol-3-yl] methanesulfonate Openeye Name: [2-(6-chloropyridazin-3-yl)-5-(4-nitrophenyl)pyrazol-3-yl] methanesulfonate CAS Name: methanesulfonic acid [2-(6-chloro-3-pyridazinyl)-5-(4-nitrophenyl)-3-pyrazolyl] ester IUPAC Name: [2-(6-chloropyridazin-3-yl)-5-(4-nitrophenyl)pyrazol-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [2-(6-chloropyridazin-3-yl)-5-(4-nitrophenyl)pyrazol-3-yl] ester Formula: C14H10ClN5O5S MolecularWeight: 395.7777

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC(=NN1C2=NN=C(C=C2)Cl)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)OC1=CC(=NN1C2=NN=C(C=C2)Cl)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H10ClN5O5S/c1-26(23,24)25-14-8-11(9-2-4-10(5-3-9)20(21)22)18-19(14)13-7-6-12(15)16-17-13/h2-8H,1H3