3-[4-(carboxymethyl)-5-(hydroxymethyl)-1H-pyrrol-3-yl]propanoic acid

Systemtic Name: 3-[4-(carboxymethyl)-5-(hydroxymethyl)-1H-pyrrol-3-yl]propanoic acid Openeye Name: 3-[4-(carboxymethyl)-5-(hydroxymethyl)-1H-pyrrol-3-yl]propanoic acid CAS Name: 3-[4-(carboxymethyl)-5-(hydroxymethyl)-1H-pyrrol-3-yl]propanoic acid IUPAC Name: 3-[4-(carboxymethyl)-5-(hydroxymethyl)-1H-pyrrol-3-yl]propanoic acid Traditional Name: 3-[4-(carboxymethyl)-5-methylol-1H-pyrrol-3-yl]propionic acid Formula: C10H13NO5 MolecularWeight: 227.21392

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(N1)CO)CC(=O)O)CCC(=O)O

Isomeric SMILES

C1=C(C(=C(N1)CO)CC(=O)O)CCC(=O)O

InChI

InChI=1S/C10H13NO5/c12-5-8-7(3-10(15)16)6(4-11-8)1-2-9(13)14/h4,11-12H,1-3,5H2,(H,13,14)(H,15,16)