4-(3,4-dimethoxyphenyl)-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-(3,4-dimethoxyphenyl)-1H-pyrrole-2-carboxylic acid Openeye Name: 4-(3,4-dimethoxyphenyl)-1H-pyrrole-2-carboxylic acid CAS Name: 4-(3,4-dimethoxyphenyl)-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-(3,4-dimethoxyphenyl)-1H-pyrrole-2-carboxylic acid Traditional Name: 4-(3,4-dimethoxyphenyl)-1H-pyrrole-2-carboxylic acid Formula: C13H13NO4 MolecularWeight: 247.24662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CNC(=C2)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CNC(=C2)C(=O)O)OC

InChI

InChI=1S/C13H13NO4/c1-17-11-4-3-8(6-12(11)18-2)9-5-10(13(15)16)14-7-9/h3-7,14H,1-2H3,(H,15,16)