4-[2-(phenylcarbonyl)pyrrol-1-yl]butanoic acid

Systemtic Name: 4-[2-(phenylcarbonyl)pyrrol-1-yl]butanoic acid Openeye Name: 4-(2-benzoylpyrrol-1-yl)butanoic acid CAS Name: 4-(2-benzoyl-1-pyrrolyl)butanoic acid IUPAC Name: 4-(2-benzoylpyrrol-1-yl)butanoic acid Traditional Name: 4-(2-benzoylpyrrol-1-yl)butyric acid Formula: C15H15NO3 MolecularWeight: 257.2845

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=CN2CCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=CN2CCCC(=O)O

InChI

InChI=1S/C15H15NO3/c17-14(18)9-5-11-16-10-4-8-13(16)15(19)12-6-2-1-3-7-12/h1-4,6-8,10H,5,9,11H2,(H,17,18)