4-(7-chloranyl-1,3-benzodioxol-5-yl)-1H-pyrrole-3-carboxylic acid

Systemtic Name: 4-(7-chloranyl-1,3-benzodioxol-5-yl)-1H-pyrrole-3-carboxylic acid Openeye Name: 4-(7-chloro-1,3-benzodioxol-5-yl)-1H-pyrrole-3-carboxylic acid CAS Name: 4-(7-chloro-1,3-benzodioxol-5-yl)-1H-pyrrole-3-carboxylic acid IUPAC Name: 4-(7-chloro-1,3-benzodioxol-5-yl)-1H-pyrrole-3-carboxylic acid Traditional Name: 4-(7-chloro-1,3-benzodioxol-5-yl)-1H-pyrrole-3-carboxylic acid Formula: C12H8ClNO4 MolecularWeight: 265.64922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8ClNO4/c13-9-1-6(2-10-11(9)18-5-17-10)7-3-14-4-8(7)12(15)16/h1-4,14H,5H2,(H,15,16)