methyl 3-[(3E)-3-[[5-(4-bromophenyl)furan-2-yl]methylidene]-2-oxidanylidene-5-phenyl-pyrrol-1-yl]benzoate

Systemtic Name: methyl 3-[(3E)-3-[[5-(4-bromophenyl)furan-2-yl]methylidene]-2-oxidanylidene-5-phenyl-pyrrol-1-yl]benzoate Openeye Name: methyl 3-[(3E)-3-[[5-(4-bromophenyl)-2-furyl]methylene]-2-oxo-5-phenyl-pyrrol-1-yl]benzoate CAS Name: 3-[(3E)-3-[[5-(4-bromophenyl)-2-furanyl]methylidene]-2-oxo-5-phenyl-1-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(3E)-3-[[5-(4-bromophenyl)furan-2-yl]methylidene]-2-oxo-5-phenylpyrrol-1-yl]benzoate Traditional Name: 3-[(3E)-3-[[5-(4-bromophenyl)-2-furyl]methylene]-2-keto-5-phenyl-2-pyrrolin-1-yl]benzoic acid methyl ester Formula: C29H20BrNO4 MolecularWeight: 526.3774

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)N2C(=CC(=CC3=CC=C(O3)C4=CC=C(C=C4)Br)C2=O)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)N2C(=C/C(=C\C3=CC=C(O3)C4=CC=C(C=C4)Br)/C2=O)C5=CC=CC=C5

InChI

InChI=1S/C29H20BrNO4/c1-34-29(33)21-8-5-9-24(16-21)31-26(19-6-3-2-4-7-19)18-22(28(31)32)17-25-14-15-27(35-25)20-10-12-23(30)13-11-20/h2-18H,1H3/b22-17+