4-(2-ethoxyphenyl)carbonyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-(2-ethoxyphenyl)carbonyl-1H-pyrrole-2-carboxylic acid Openeye Name: 4-(2-ethoxybenzoyl)-1H-pyrrole-2-carboxylic acid CAS Name: 4-[(2-ethoxyphenyl)-oxomethyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-(2-ethoxybenzoyl)-1H-pyrrole-2-carboxylic acid Traditional Name: 4-(2-ethoxybenzoyl)-1H-pyrrole-2-carboxylic acid Formula: C14H13NO4 MolecularWeight: 259.25732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)C2=CNC(=C2)C(=O)O

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)C2=CNC(=C2)C(=O)O

InChI

InChI=1S/C14H13NO4/c1-2-19-12-6-4-3-5-10(12)13(16)9-7-11(14(17)18)15-8-9/h3-8,15H,2H2,1H3,(H,17,18)