3-[(2-methanoylpyrrol-1-yl)methyl]benzoic acid

Systemtic Name: 3-[(2-methanoylpyrrol-1-yl)methyl]benzoic acid Openeye Name: 3-[(2-formylpyrrol-1-yl)methyl]benzoic acid CAS Name: 3-[(2-formyl-1-pyrrolyl)methyl]benzoic acid IUPAC Name: 3-[(2-formylpyrrol-1-yl)methyl]benzoic acid Traditional Name: 3-[(2-formylpyrrol-1-yl)methyl]benzoic acid Formula: C13H11NO3 MolecularWeight: 229.23134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11NO3/c15-9-12-5-2-6-14(12)8-10-3-1-4-11(7-10)13(16)17/h1-7,9H,8H2,(H,16,17)