diethyl 2-nitro-1-(phenylmethyl)pyrrole-3,4-dicarboxylate

Systemtic Name: diethyl 2-nitro-1-(phenylmethyl)pyrrole-3,4-dicarboxylate Openeye Name: diethyl 1-benzyl-2-nitro-pyrrole-3,4-dicarboxylate CAS Name: 2-nitro-1-(phenylmethyl)pyrrole-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-benzyl-2-nitropyrrole-3,4-dicarboxylate Traditional Name: 1-benzyl-2-nitro-pyrrole-3,4-dicarboxylic acid diethyl ester Formula: C17H18N2O6 MolecularWeight: 346.33462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C(=C1C(=O)OCC)[N+](=O)[O-])CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CN(C(=C1C(=O)OCC)[N+](=O)[O-])CC2=CC=CC=C2

InChI

InChI=1S/C17H18N2O6/c1-3-24-16(20)13-11-18(10-12-8-6-5-7-9-12)15(19(22)23)14(13)17(21)25-4-2/h5-9,11H,3-4,10H2,1-2H3