3,4,5-trimethyl-1-(3-nitrophenyl)sulfonyl-pyrazole

Systemtic Name: 3,4,5-trimethyl-1-(3-nitrophenyl)sulfonyl-pyrazole Openeye Name: 3,4,5-trimethyl-1-(3-nitrophenyl)sulfonyl-pyrazole CAS Name: 3,4,5-trimethyl-1-(3-nitrophenyl)sulfonylpyrazole IUPAC Name: 3,4,5-trimethyl-1-(3-nitrophenyl)sulfonylpyrazole Traditional Name: 3,4,5-trimethyl-1-(3-nitrophenyl)sulfonyl-pyrazole Formula: C12H13N3O4S MolecularWeight: 295.31432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(N(N=C1C)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C

InChI

InChI=1S/C12H13N3O4S/c1-8-9(2)13-14(10(8)3)20(18,19)12-6-4-5-11(7-12)15(16)17/h4-7H,1-3H3