2-[5-(phenylcarbonyl)-1H-pyrrol-2-yl]propanedioic acid

Systemtic Name: 2-[5-(phenylcarbonyl)-1H-pyrrol-2-yl]propanedioic acid Openeye Name: 2-(5-benzoyl-1H-pyrrol-2-yl)propanedioic acid CAS Name: 2-(5-benzoyl-1H-pyrrol-2-yl)propanedioic acid IUPAC Name: 2-(5-benzoyl-1H-pyrrol-2-yl)propanedioic acid Traditional Name: 2-(5-benzoyl-1H-pyrrol-2-yl)malonic acid Formula: C14H11NO5 MolecularWeight: 273.24084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=C(N2)C(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=C(N2)C(C(=O)O)C(=O)O

InChI

InChI=1S/C14H11NO5/c16-12(8-4-2-1-3-5-8)10-7-6-9(15-10)11(13(17)18)14(19)20/h1-7,11,15H,(H,17,18)(H,19,20)