ethyl 1-(4-bromophenyl)-2-methyl-4-[(4-nitrophenyl)methylidene]-5-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-(4-bromophenyl)-2-methyl-4-[(4-nitrophenyl)methylidene]-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: ethyl 1-(4-bromophenyl)-2-methyl-4-[(4-nitrophenyl)methylene]-5-oxo-pyrrole-3-carboxylate CAS Name: 1-(4-bromophenyl)-2-methyl-4-[(4-nitrophenyl)methylidene]-5-oxo-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-bromophenyl)-2-methyl-4-[(4-nitrophenyl)methylidene]-5-oxopyrrole-3-carboxylate Traditional Name: 1-(4-bromophenyl)-5-keto-2-methyl-4-(4-nitrobenzylidene)-2-pyrroline-3-carboxylic acid ethyl ester Formula: C21H17BrN2O5 MolecularWeight: 457.27408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)C1=CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Br)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)C1=CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C21H17BrN2O5/c1-3-29-21(26)19-13(2)23(16-10-6-15(22)7-11-16)20(25)18(19)12-14-4-8-17(9-5-14)24(27)28/h4-12H,3H2,1-2H3