O4-tert-butyl O2-ethyl 5-methyl-3-(2-nitrophenyl)-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-tert-butyl O2-ethyl 5-methyl-3-(2-nitrophenyl)-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-tert-butyl O2-ethyl 5-methyl-3-(2-nitrophenyl)-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-methyl-3-(2-nitrophenyl)-1H-pyrrole-2,4-dicarboxylic acid O4-tert-butyl ester O2-ethyl ester IUPAC Name: 4-O-tert-butyl 2-O-ethyl 5-methyl-3-(2-nitrophenyl)-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-methyl-3-(2-nitrophenyl)-1H-pyrrole-2,4-dicarboxylic acid O4-tert-butyl ester O2-ethyl ester Formula: C19H22N2O6 MolecularWeight: 374.38778

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OC(C)(C)C)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OC(C)(C)C)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C19H22N2O6/c1-6-26-18(23)16-15(12-9-7-8-10-13(12)21(24)25)14(11(2)20-16)17(22)27-19(3,4)5/h7-10,20H,6H2,1-5H3