3,5-dimethoxy-4-pyrrol-1-yl-benzoic acid

Systemtic Name: 3,5-dimethoxy-4-pyrrol-1-yl-benzoic acid Openeye Name: 3,5-dimethoxy-4-pyrrol-1-yl-benzoic acid CAS Name: 3,5-dimethoxy-4-(1-pyrrolyl)benzoic acid IUPAC Name: 3,5-dimethoxy-4-pyrrol-1-ylbenzoic acid Traditional Name: 3,5-dimethoxy-4-pyrrol-1-yl-benzoic acid Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1N2C=CC=C2)OC)C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1N2C=CC=C2)OC)C(=O)O

InChI

InChI=1S/C13H13NO4/c1-17-10-7-9(13(15)16)8-11(18-2)12(10)14-5-3-4-6-14/h3-8H,1-2H3,(H,15,16)