phenyl 1-methyl-4-nitro-pyrrole-2-carboxylate

Systemtic Name: phenyl 1-methyl-4-nitro-pyrrole-2-carboxylate Openeye Name: phenyl 1-methyl-4-nitro-pyrrole-2-carboxylate CAS Name: 1-methyl-4-nitro-2-pyrrolecarboxylic acid phenyl ester IUPAC Name: phenyl 1-methyl-4-nitropyrrole-2-carboxylate Traditional Name: 1-methyl-4-nitro-pyrrole-2-carboxylic acid phenyl ester Formula: C12H10N2O4 MolecularWeight: 246.2188

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)OC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H10N2O4/c1-13-8-9(14(16)17)7-11(13)12(15)18-10-5-3-2-4-6-10/h2-8H,1H3