2-[1-methyl-5-(2-methylpropanoyl)pyrrol-2-yl]ethanoic acid

Systemtic Name: 2-[1-methyl-5-(2-methylpropanoyl)pyrrol-2-yl]ethanoic acid Openeye Name: 2-[1-methyl-5-(2-methylpropanoyl)pyrrol-2-yl]acetic acid CAS Name: 2-[1-methyl-5-(2-methyl-1-oxopropyl)-2-pyrrolyl]acetic acid IUPAC Name: 2-[1-methyl-5-(2-methylpropanoyl)pyrrol-2-yl]acetic acid Traditional Name: 2-(5-isobutyryl-1-methyl-pyrrol-2-yl)acetic acid Formula: C11H15NO3 MolecularWeight: 209.2417

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1=CC=C(N1C)CC(=O)O

Isomeric SMILES

CC(C)C(=O)C1=CC=C(N1C)CC(=O)O

InChI

InChI=1S/C11H15NO3/c1-7(2)11(15)9-5-4-8(12(9)3)6-10(13)14/h4-5,7H,6H2,1-3H3,(H,13,14)