5-(1,3-benzodioxol-4-yl)-1H-pyrrole-2-carboxylic acid

Systemtic Name: 5-(1,3-benzodioxol-4-yl)-1H-pyrrole-2-carboxylic acid Openeye Name: 5-(1,3-benzodioxol-4-yl)-1H-pyrrole-2-carboxylic acid CAS Name: 5-(1,3-benzodioxol-4-yl)-1H-pyrrole-2-carboxylic acid IUPAC Name: 5-(1,3-benzodioxol-4-yl)-1H-pyrrole-2-carboxylic acid Traditional Name: 5-(1,3-benzodioxol-4-yl)-1H-pyrrole-2-carboxylic acid Formula: C12H9NO4 MolecularWeight: 231.20416

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=CC=CC(=C2O1)C3=CC=C(N3)C(=O)O

Isomeric SMILES

C1OC2=CC=CC(=C2O1)C3=CC=C(N3)C(=O)O

InChI

InChI=1S/C12H9NO4/c14-12(15)9-5-4-8(13-9)7-2-1-3-10-11(7)17-6-16-10/h1-5,13H,6H2,(H,14,15)