tert-butyl 4-ethyl-3-(4-nitrophenyl)-1-[(4-nitrophenyl)methyl]pyrrole-2-carboxylate

Systemtic Name: tert-butyl 4-ethyl-3-(4-nitrophenyl)-1-[(4-nitrophenyl)methyl]pyrrole-2-carboxylate Openeye Name: tert-butyl 4-ethyl-3-(4-nitrophenyl)-1-[(4-nitrophenyl)methyl]pyrrole-2-carboxylate CAS Name: 4-ethyl-3-(4-nitrophenyl)-1-[(4-nitrophenyl)methyl]-2-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-ethyl-3-(4-nitrophenyl)-1-[(4-nitrophenyl)methyl]pyrrole-2-carboxylate Traditional Name: 4-ethyl-1-(4-nitrobenzyl)-3-(4-nitrophenyl)pyrrole-2-carboxylic acid tert-butyl ester Formula: C24H25N3O6 MolecularWeight: 451.4718

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN(C(=C1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC(C)(C)C)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=CN(C(=C1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC(C)(C)C)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H25N3O6/c1-5-17-15-25(14-16-6-10-19(11-7-16)26(29)30)22(23(28)33-24(2,3)4)21(17)18-8-12-20(13-9-18)27(31)32/h6-13,15H,5,14H2,1-4H3