2-(4-aminocarbonyl-1H-imidazol-5-yl)-1,3-benzodioxole-5-carboxylic acid

Systemtic Name: 2-(4-aminocarbonyl-1H-imidazol-5-yl)-1,3-benzodioxole-5-carboxylic acid Openeye Name: 2-(4-carbamoyl-1H-imidazol-5-yl)-1,3-benzodioxole-5-carboxylic acid CAS Name: 2-(4-carbamoyl-1H-imidazol-5-yl)-1,3-benzodioxole-5-carboxylic acid IUPAC Name: 2-(4-carbamoyl-1H-imidazol-5-yl)-1,3-benzodioxole-5-carboxylic acid Traditional Name: 2-(4-carbamoyl-1H-imidazol-5-yl)-piperonylic acid Formula: C12H9N3O5 MolecularWeight: 275.21696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)O)OC(O2)C3=C(N=CN3)C(=O)N

Isomeric SMILES

C1=CC2=C(C=C1C(=O)O)OC(O2)C3=C(N=CN3)C(=O)N

InChI

InChI=1S/C12H9N3O5/c13-10(16)8-9(15-4-14-8)12-19-6-2-1-5(11(17)18)3-7(6)20-12/h1-4,12H,(H2,13,16)(H,14,15)(H,17,18)