3-ethanoyl-4,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: 3-ethanoyl-4,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: 3-acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 3-acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylate IUPAC Name: 3-acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 3-acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylate Formula: C9H10NO3- MolecularWeight: 180.1806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C(=O)[O-])C

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C(=O)[O-])C

InChI

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