4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1H-pyrrole-2-carboxylic acid Openeye Name: 4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1H-pyrrole-2-carboxylic acid CAS Name: 4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1H-pyrrole-2-carboxylic acid Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)-1H-pyrrole-2-carboxylic acid Formula: C14H11NO5 MolecularWeight: 273.24084

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)C3=CNC(=C3)C(=O)O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)C3=CNC(=C3)C(=O)O

InChI

InChI=1S/C14H11NO5/c16-13(9-5-10(14(17)18)15-7-9)8-1-2-11-12(6-8)20-4-3-19-11/h1-2,5-7,15H,3-4H2,(H,17,18)