(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-(4-nitrophenyl)methanone

Systemtic Name: (4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-(4-nitrophenyl)methanone Openeye Name: (4-chloro-3,5-dimethyl-pyrazol-1-yl)-(4-nitrophenyl)methanone CAS Name: (4-chloro-3,5-dimethyl-1-pyrazolyl)-(4-nitrophenyl)methanone IUPAC Name: (4-chloro-3,5-dimethylpyrazol-1-yl)-(4-nitrophenyl)methanone Traditional Name: (4-chloro-3,5-dimethyl-pyrazol-1-yl)-(4-nitrophenyl)methanone Formula: C12H10ClN3O3 MolecularWeight: 279.6791

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C)Cl

Isomeric SMILES

CC1=C(C(=NN1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C)Cl

InChI

InChI=1S/C12H10ClN3O3/c1-7-11(13)8(2)15(14-7)12(17)9-3-5-10(6-4-9)16(18)19/h3-6H,1-2H3