4-cyano-1-(2-oxidanyl-2-phenyl-ethyl)pyrrole-2-carboxylic acid

Systemtic Name: 4-cyano-1-(2-oxidanyl-2-phenyl-ethyl)pyrrole-2-carboxylic acid Openeye Name: 4-cyano-1-(2-hydroxy-2-phenyl-ethyl)pyrrole-2-carboxylic acid CAS Name: 4-cyano-1-(2-hydroxy-2-phenylethyl)-2-pyrrolecarboxylic acid IUPAC Name: 4-cyano-1-(2-hydroxy-2-phenylethyl)pyrrole-2-carboxylic acid Traditional Name: 4-cyano-1-(2-hydroxy-2-phenyl-ethyl)pyrrole-2-carboxylic acid Formula: C14H12N2O3 MolecularWeight: 256.25668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CN2C=C(C=C2C(=O)O)C#N)O

Isomeric SMILES

C1=CC=C(C=C1)C(CN2C=C(C=C2C(=O)O)C#N)O

InChI

InChI=1S/C14H12N2O3/c15-7-10-6-12(14(18)19)16(8-10)9-13(17)11-4-2-1-3-5-11/h1-6,8,13,17H,9H2,(H,18,19)