3-cyano-1-(2,4-dimethylphenyl)pyrrole-2-carboxylic acid

Systemtic Name: 3-cyano-1-(2,4-dimethylphenyl)pyrrole-2-carboxylic acid Openeye Name: 3-cyano-1-(2,4-dimethylphenyl)pyrrole-2-carboxylic acid CAS Name: 3-cyano-1-(2,4-dimethylphenyl)-2-pyrrolecarboxylic acid IUPAC Name: 3-cyano-1-(2,4-dimethylphenyl)pyrrole-2-carboxylic acid Traditional Name: 3-cyano-1-(2,4-dimethylphenyl)pyrrole-2-carboxylic acid Formula: C14H12N2O2 MolecularWeight: 240.25728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=CC(=C2C(=O)O)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=CC(=C2C(=O)O)C#N)C

InChI

InChI=1S/C14H12N2O2/c1-9-3-4-12(10(2)7-9)16-6-5-11(8-15)13(16)14(17)18/h3-7H,1-2H3,(H,17,18)