(2-nitrophenyl)methyl 1,5-dimethylpyrazole-4-carboxylate

Systemtic Name: (2-nitrophenyl)methyl 1,5-dimethylpyrazole-4-carboxylate Openeye Name: (2-nitrophenyl)methyl 1,5-dimethylpyrazole-4-carboxylate CAS Name: 1,5-dimethyl-4-pyrazolecarboxylic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 1,5-dimethylpyrazole-4-carboxylate Traditional Name: 1,5-dimethylpyrazole-4-carboxylic acid (2-nitrobenzyl) ester Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C(=O)OCC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=NN1C)C(=O)OCC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O4/c1-9-11(7-14-15(9)2)13(17)20-8-10-5-3-4-6-12(10)16(18)19/h3-7H,8H2,1-2H3