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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C)C(=O)O)C(=O)C

Isomeric SMILES

CC1=C(C(=C(N1)C)C(=O)O)C(=O)C

InChI

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