5-methoxy-3-indoleacetic acid

• 5-methoxy-3-indoleacetic acid
• bmse000694 - data

InCHi String:
InChI=1S/C11H11NO3/c1-15-8-2-3-10-9(5-8)7(6-12-10)4-11(13)14/h2-3,5-6,12H,4H2,1H3,(H,13,14)

canonical and isomeric SMILES:
COC1=CC2=C(C=C1)NC=C2CC(=O)O


PUBCHEM iupac NAME: PUBCHEM iupac TRADITIONAL NAME: PUBCHEM iupac OPENEYE NAME: PUBCHEM iupac CAS NAME
2-(5-methoxy-1H-indol-3-yl)acetic acid

PUBCHEM iupac SYSTEMATIC NAME
2-(5-methoxy-1H-indol-3-yl)ethanoic acid



PubChem Substance (SID):   111677832   161944   803911
PubChem Compound (CID):   18986
KEGG: Compound ID   M14935_ALDRICH
CAS Registry IDs:   110885-75-1   3471-31-6
PDB Chemical Component   n/a
Miscellaneous Databases and IDs:   Sigma-Aldrich M14935_ALDRICH   ChEBI CHEBI:235589   ChemIDplus 003471316   EINECS 222-438-3   NIAID 166242   ChemDB 4559084   NIST 2380176688   MMCD cq_03186   MDL MFCD00005638