tert-butyl 3-ethyl-5-methanoyl-4-(4-nitrophenyl)-1H-pyrrole-2-carboxylate

Systemtic Name: tert-butyl 3-ethyl-5-methanoyl-4-(4-nitrophenyl)-1H-pyrrole-2-carboxylate Openeye Name: tert-butyl 3-ethyl-5-formyl-4-(4-nitrophenyl)-1H-pyrrole-2-carboxylate CAS Name: 3-ethyl-5-formyl-4-(4-nitrophenyl)-1H-pyrrole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-ethyl-5-formyl-4-(4-nitrophenyl)-1H-pyrrole-2-carboxylate Traditional Name: 3-ethyl-5-formyl-4-(4-nitrophenyl)-1H-pyrrole-2-carboxylic acid tert-butyl ester Formula: C18H20N2O5 MolecularWeight: 344.3618

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C2=CC=C(C=C2)[N+](=O)[O-])C=O)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=C(NC(=C1C2=CC=C(C=C2)[N+](=O)[O-])C=O)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H20N2O5/c1-5-13-15(11-6-8-12(9-7-11)20(23)24)14(10-21)19-16(13)17(22)25-18(2,3)4/h6-10,19H,5H2,1-4H3