1-[5-(2-chloranyl-4-methylsulfonyl-phenoxy)-2-nitro-phenyl]sulfonyl-3,5-dimethyl-pyrazole

Systemtic Name: 1-[5-(2-chloranyl-4-methylsulfonyl-phenoxy)-2-nitro-phenyl]sulfonyl-3,5-dimethyl-pyrazole Openeye Name: 1-[5-(2-chloro-4-methylsulfonyl-phenoxy)-2-nitro-phenyl]sulfonyl-3,5-dimethyl-pyrazole CAS Name: 1-[5-(2-chloro-4-methylsulfonylphenoxy)-2-nitrophenyl]sulfonyl-3,5-dimethylpyrazole IUPAC Name: 1-[5-(2-chloro-4-methylsulfonylphenoxy)-2-nitrophenyl]sulfonyl-3,5-dimethylpyrazole Traditional Name: 1-[5-(2-chloro-4-mesyl-phenoxy)-2-nitro-phenyl]sulfonyl-3,5-dimethyl-pyrazole Formula: C18H16ClN3O7S2 MolecularWeight: 485.91854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1S(=O)(=O)C2=C(C=CC(=C2)OC3=C(C=C(C=C3)S(=O)(=O)C)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1S(=O)(=O)C2=C(C=CC(=C2)OC3=C(C=C(C=C3)S(=O)(=O)C)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C18H16ClN3O7S2/c1-11-8-12(2)21(20-11)31(27,28)18-9-13(4-6-16(18)22(23)24)29-17-7-5-14(10-15(17)19)30(3,25)26/h4-10H,1-3H3