2-[3-(phenylcarbonyl)pyrrol-1-yl]ethanoic acid

Systemtic Name: 2-[3-(phenylcarbonyl)pyrrol-1-yl]ethanoic acid Openeye Name: 2-(3-benzoylpyrrol-1-yl)acetic acid CAS Name: 2-(3-benzoyl-1-pyrrolyl)acetic acid IUPAC Name: 2-(3-benzoylpyrrol-1-yl)acetic acid Traditional Name: 2-(3-benzoylpyrrol-1-yl)acetic acid Formula: C13H11NO3 MolecularWeight: 229.23134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11NO3/c15-12(16)9-14-7-6-11(8-14)13(17)10-4-2-1-3-5-10/h1-8H,9H2,(H,15,16)