2-[6-(hydroxymethyl)-1H-indol-3-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[6-(hydroxymethyl)-1H-indol-3-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[6-(hydroxymethyl)-1H-indol-3-yl]-2-oxo-acetic acid CAS Name: 2-[6-(hydroxymethyl)-1H-indol-3-yl]-2-oxoacetic acid IUPAC Name: 2-[6-(hydroxymethyl)-1H-indol-3-yl]-2-oxoacetic acid Traditional Name: 2-keto-2-(6-methylol-1H-indol-3-yl)acetic acid Formula: C11H9NO4 MolecularWeight: 219.19346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CO)NC=C2C(=O)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1CO)NC=C2C(=O)C(=O)O

InChI

InChI=1S/C11H9NO4/c13-5-6-1-2-7-8(10(14)11(15)16)4-12-9(7)3-6/h1-4,12-13H,5H2,(H,15,16)