pyridin-2-ylmethyl 1-methyl-4-nitro-pyrrole-2-carboxylate

Systemtic Name: pyridin-2-ylmethyl 1-methyl-4-nitro-pyrrole-2-carboxylate Openeye Name: 2-pyridylmethyl 1-methyl-4-nitro-pyrrole-2-carboxylate CAS Name: 1-methyl-4-nitro-2-pyrrolecarboxylic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 1-methyl-4-nitropyrrole-2-carboxylate Traditional Name: 1-methyl-4-nitro-pyrrole-2-carboxylic acid 2-pyridylmethyl ester Formula: C12H11N3O4 MolecularWeight: 261.23344

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OCC2=CC=CC=N2)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)OCC2=CC=CC=N2)[N+](=O)[O-]

InChI

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