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

Systemtic Name: 4-cyano-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Openeye Name: 4-cyano-3,5-dimethyl-1H-pyrrole-2-carboxylic acid CAS Name: 4-cyano-3,5-dimethyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-cyano-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Traditional Name: 4-cyano-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Formula: C8H8N2O2 MolecularWeight: 164.16132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H8N2O2/c1-4-6(3-9)5(2)10-7(4)8(11)12/h10H,1-2H3,(H,11,12)