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

Systemtic Name: 1-[(2-chloranyl-5-nitro-phenyl)methyl]-3,5-dimethyl-4-nitro-pyrazole Openeye Name: 1-[(2-chloro-5-nitro-phenyl)methyl]-3,5-dimethyl-4-nitro-pyrazole CAS Name: 1-[(2-chloro-5-nitrophenyl)methyl]-3,5-dimethyl-4-nitropyrazole IUPAC Name: 1-[(2-chloro-5-nitrophenyl)methyl]-3,5-dimethyl-4-nitropyrazole Traditional Name: 1-(2-chloro-5-nitro-benzyl)-3,5-dimethyl-4-nitro-pyrazole Formula: C12H11ClN4O4 MolecularWeight: 310.69314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C12H11ClN4O4/c1-7-12(17(20)21)8(2)15(14-7)6-9-5-10(16(18)19)3-4-11(9)13/h3-5H,6H2,1-2H3