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

Systemtic Name: 2-iodanyl-4-[2-(phenylcarbonyl)pyrrol-1-yl]butanoic acid Openeye Name: 4-(2-benzoylpyrrol-1-yl)-2-iodo-butanoic acid CAS Name: 4-(2-benzoyl-1-pyrrolyl)-2-iodobutanoic acid IUPAC Name: 4-(2-benzoylpyrrol-1-yl)-2-iodobutanoic acid Traditional Name: 4-(2-benzoylpyrrol-1-yl)-2-iodo-butyric acid Formula: C15H14INO3 MolecularWeight: 383.18103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=CN2CCC(C(=O)O)I

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=CN2CCC(C(=O)O)I

InChI

InChI=1S/C15H14INO3/c16-12(15(19)20)8-10-17-9-4-7-13(17)14(18)11-5-2-1-3-6-11/h1-7,9,12H,8,10H2,(H,19,20)