methyl 1-[(2-nitrophenyl)methyl]pyrazole-3-carboxylate

Systemtic Name: methyl 1-[(2-nitrophenyl)methyl]pyrazole-3-carboxylate Openeye Name: methyl 1-[(2-nitrophenyl)methyl]pyrazole-3-carboxylate CAS Name: 1-[(2-nitrophenyl)methyl]-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[(2-nitrophenyl)methyl]pyrazole-3-carboxylate Traditional Name: 1-(2-nitrobenzyl)pyrazole-3-carboxylic acid methyl ester Formula: C12H11N3O4 MolecularWeight: 261.23344

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C=C1)CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=NN(C=C1)CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O4/c1-19-12(16)10-6-7-14(13-10)8-9-4-2-3-5-11(9)15(17)18/h2-7H,8H2,1H3