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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CNC=C3C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CNC=C3C(=O)O

InChI

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