4-[2-(4-bromophenyl)-5-(3-oxidanidyl-3-oxidanylidene-propyl)pyrrol-1-yl]benzoate

Systemtic Name: 4-[2-(4-bromophenyl)-5-(3-oxidanidyl-3-oxidanylidene-propyl)pyrrol-1-yl]benzoate Openeye Name: 4-[2-(4-bromophenyl)-5-(3-oxido-3-oxo-propyl)pyrrol-1-yl]benzoate CAS Name: 4-[2-(4-bromophenyl)-5-(3-oxido-3-oxopropyl)-1-pyrrolyl]benzoate IUPAC Name: 4-[2-(4-bromophenyl)-5-(3-oxido-3-oxopropyl)pyrrol-1-yl]benzoate Traditional Name: 4-[2-(4-bromophenyl)-5-(3-keto-3-oxido-propyl)pyrrol-1-yl]benzoate Formula: C20H14BrNO4-2 MolecularWeight: 412.23346

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(N2C3=CC=C(C=C3)C(=O)[O-])CCC(=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(N2C3=CC=C(C=C3)C(=O)[O-])CCC(=O)[O-])Br

InChI

InChI=1S/C20H16BrNO4/c21-15-5-1-13(2-6-15)18-11-9-17(10-12-19(23)24)22(18)16-7-3-14(4-8-16)20(25)26/h1-9,11H,10,12H2,(H,23,24)(H,25,26)/p-2