2-(5-ethanoyl-1,4-dimethyl-pyrrol-2-yl)-2-methyl-propanoic acid

Systemtic Name: 2-(5-ethanoyl-1,4-dimethyl-pyrrol-2-yl)-2-methyl-propanoic acid Openeye Name: 2-(5-acetyl-1,4-dimethyl-pyrrol-2-yl)-2-methyl-propanoic acid CAS Name: 2-(5-acetyl-1,4-dimethyl-2-pyrrolyl)-2-methylpropanoic acid IUPAC Name: 2-(5-acetyl-1,4-dimethylpyrrol-2-yl)-2-methylpropanoic acid Traditional Name: 2-(5-acetyl-1,4-dimethyl-pyrrol-2-yl)-2-methyl-propionic acid Formula: C12H17NO3 MolecularWeight: 223.26828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1)C(C)(C)C(=O)O)C)C(=O)C

Isomeric SMILES

CC1=C(N(C(=C1)C(C)(C)C(=O)O)C)C(=O)C

InChI

InChI=1S/C12H17NO3/c1-7-6-9(12(3,4)11(15)16)13(5)10(7)8(2)14/h6H,1-5H3,(H,15,16)