2-(5-methyl-2-pyrrol-1-yl-phenyl)ethanoic acid

Systemtic Name: 2-(5-methyl-2-pyrrol-1-yl-phenyl)ethanoic acid Openeye Name: 2-(5-methyl-2-pyrrol-1-yl-phenyl)acetic acid CAS Name: 2-[5-methyl-2-(1-pyrrolyl)phenyl]acetic acid IUPAC Name: 2-(5-methyl-2-pyrrol-1-ylphenyl)acetic acid Traditional Name: 2-(5-methyl-2-pyrrol-1-yl-phenyl)acetic acid Formula: C13H13NO2 MolecularWeight: 215.24782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=CC=C2)CC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=CC=C2)CC(=O)O

InChI

InChI=1S/C13H13NO2/c1-10-4-5-12(14-6-2-3-7-14)11(8-10)9-13(15)16/h2-8H,9H2,1H3,(H,15,16)