O3,O4-dimethyl O2-(4-nitrophenyl) 5-phenyl-1H-pyrrole-2,3,4-tricarboxylate

Systemtic Name: O3,O4-dimethyl O2-(4-nitrophenyl) 5-phenyl-1H-pyrrole-2,3,4-tricarboxylate Openeye Name: O3,O4-dimethyl O2-(4-nitrophenyl) 5-phenyl-1H-pyrrole-2,3,4-tricarboxylate CAS Name: 5-phenyl-1H-pyrrole-2,3,4-tricarboxylic acid O3,O4-dimethyl ester O2-(4-nitrophenyl) ester IUPAC Name: 3-O,4-O-dimethyl 2-O-(4-nitrophenyl) 5-phenyl-1H-pyrrole-2,3,4-tricarboxylate Traditional Name: 5-phenyl-1H-pyrrole-2,3,4-tricarboxylic acid O3,O4-dimethyl ester O2-(4-nitrophenyl) ester Formula: C21H16N2O8 MolecularWeight: 424.36034

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(NC(=C1C(=O)OC)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(NC(=C1C(=O)OC)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C21H16N2O8/c1-29-19(24)15-16(20(25)30-2)18(22-17(15)12-6-4-3-5-7-12)21(26)31-14-10-8-13(9-11-14)23(27)28/h3-11,22H,1-2H3