4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Openeye Name: 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid CAS Name: 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Traditional Name: 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Formula: C9H11NO3 MolecularWeight: 181.18854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)O

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)O

InChI

InChI=1S/C9H11NO3/c1-4-7(6(3)11)5(2)10-8(4)9(12)13/h10H,1-3H3,(H,12,13)