3-cyano-4-ethanoyl-5-methyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 3-cyano-4-ethanoyl-5-methyl-1H-pyrrole-2-carboxylic acid Openeye Name: 4-acetyl-3-cyano-5-methyl-1H-pyrrole-2-carboxylic acid CAS Name: 4-acetyl-3-cyano-5-methyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-acetyl-3-cyano-5-methyl-1H-pyrrole-2-carboxylic acid Traditional Name: 4-acetyl-3-cyano-5-methyl-1H-pyrrole-2-carboxylic acid Formula: C9H8N2O3 MolecularWeight: 192.17142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C(=O)O)C#N)C(=O)C

Isomeric SMILES

CC1=C(C(=C(N1)C(=O)O)C#N)C(=O)C

InChI

InChI=1S/C9H8N2O3/c1-4-7(5(2)12)6(3-10)8(11-4)9(13)14/h11H,1-2H3,(H,13,14)