ethyl 4-[(3Z)-3-[[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]methylidene]-2-oxidanylidene-5-phenyl-pyrrol-1-yl]benzoate

Systemtic Name: ethyl 4-[(3Z)-3-[[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]methylidene]-2-oxidanylidene-5-phenyl-pyrrol-1-yl]benzoate Openeye Name: ethyl 4-[(3Z)-3-[[5-(2-bromo-4-nitro-phenyl)-2-furyl]methylene]-2-oxo-5-phenyl-pyrrol-1-yl]benzoate CAS Name: 4-[(3Z)-3-[[5-(2-bromo-4-nitrophenyl)-2-furanyl]methylidene]-2-oxo-5-phenyl-1-pyrrolyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3Z)-3-[[5-(2-bromo-4-nitrophenyl)furan-2-yl]methylidene]-2-oxo-5-phenylpyrrol-1-yl]benzoate Traditional Name: 4-[(3Z)-3-[[5-(2-bromo-4-nitro-phenyl)-2-furyl]methylene]-2-keto-5-phenyl-2-pyrrolin-1-yl]benzoic acid ethyl ester Formula: C30H21BrN2O6 MolecularWeight: 585.40154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=CC3=CC=C(O3)C4=C(C=C(C=C4)[N+](=O)[O-])Br)C2=O)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=C/C(=C/C3=CC=C(O3)C4=C(C=C(C=C4)[N+](=O)[O-])Br)/C2=O)C5=CC=CC=C5

InChI

InChI=1S/C30H21BrN2O6/c1-2-38-30(35)20-8-10-22(11-9-20)32-27(19-6-4-3-5-7-19)17-21(29(32)34)16-24-13-15-28(39-24)25-14-12-23(33(36)37)18-26(25)31/h3-18H,2H2,1H3/b21-16-