2-[5-(carboxymethyl)-1-methyl-pyrrol-2-yl]ethanoic acid

Systemtic Name: 2-[5-(carboxymethyl)-1-methyl-pyrrol-2-yl]ethanoic acid Openeye Name: 2-[5-(carboxymethyl)-1-methyl-pyrrol-2-yl]acetic acid CAS Name: 2-[5-(carboxymethyl)-1-methyl-2-pyrrolyl]acetic acid IUPAC Name: 2-[5-(carboxymethyl)-1-methylpyrrol-2-yl]acetic acid Traditional Name: 2-[5-(carboxymethyl)-1-methyl-pyrrol-2-yl]acetic acid Formula: C9H11NO4 MolecularWeight: 197.18794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1CC(=O)O)CC(=O)O

Isomeric SMILES

CN1C(=CC=C1CC(=O)O)CC(=O)O

InChI

InChI=1S/C9H11NO4/c1-10-6(4-8(11)12)2-3-7(10)5-9(13)14/h2-3H,4-5H2,1H3,(H,11,12)(H,13,14)