dimethyl 3-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-4-nitro-1-phenyl-pyrrole-2,5-dicarboxylate

Systemtic Name: dimethyl 3-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-4-nitro-1-phenyl-pyrrole-2,5-dicarboxylate Openeye Name: dimethyl 3-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-nitro-1-phenyl-pyrrole-2,5-dicarboxylate CAS Name: 3-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-4-nitro-1-phenylpyrrole-2,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-nitro-1-phenylpyrrole-2,5-dicarboxylate Traditional Name: 3-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-4-nitro-1-phenyl-pyrrole-2,5-dicarboxylic acid dimethyl ester Formula: C19H20N2O9 MolecularWeight: 420.3701

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=C(N1C2=CC=CC=C2)C(=O)OC)[N+](=O)[O-])C3CC(C(O3)CO)O

Isomeric SMILES

COC(=O)C1=C(C(=C(N1C2=CC=CC=C2)C(=O)OC)[N+](=O)[O-])C3CC(C(O3)CO)O

InChI

InChI=1S/C19H20N2O9/c1-28-18(24)16-14(12-8-11(23)13(9-22)30-12)15(21(26)27)17(19(25)29-2)20(16)10-6-4-3-5-7-10/h3-7,11-13,22-23H,8-9H2,1-2H3