(2,4-dimethylphenyl) 2,5-dimethyl-4-nitro-pyrazole-3-carboxylate

Systemtic Name: (2,4-dimethylphenyl) 2,5-dimethyl-4-nitro-pyrazole-3-carboxylate Openeye Name: (2,4-dimethylphenyl) 2,5-dimethyl-4-nitro-pyrazole-3-carboxylate CAS Name: 2,5-dimethyl-4-nitro-3-pyrazolecarboxylic acid (2,4-dimethylphenyl) ester IUPAC Name: (2,4-dimethylphenyl) 2,5-dimethyl-4-nitropyrazole-3-carboxylate Traditional Name: 2,5-dimethyl-4-nitro-pyrazole-3-carboxylic acid (2,4-dimethylphenyl) ester Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2=C(C(=NN2C)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2=C(C(=NN2C)C)[N+](=O)[O-])C

InChI

InChI=1S/C14H15N3O4/c1-8-5-6-11(9(2)7-8)21-14(18)13-12(17(19)20)10(3)15-16(13)4/h5-7H,1-4H3