5-(diethylcarbamoyl)-1,3-benzodioxole-4-carboxylic acid

Systemtic Name: 5-(diethylcarbamoyl)-1,3-benzodioxole-4-carboxylic acid Openeye Name: 5-(diethylcarbamoyl)-1,3-benzodioxole-4-carboxylic acid CAS Name: 5-[diethylamino(oxo)methyl]-1,3-benzodioxole-4-carboxylic acid IUPAC Name: 5-(diethylcarbamoyl)-1,3-benzodioxole-4-carboxylic acid Traditional Name: 5-(diethylcarbamoyl)-1,3-benzodioxole-4-carboxylic acid Formula: C13H15NO5 MolecularWeight: 265.2619

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C2=C(C=C1)OCO2)C(=O)O

Isomeric SMILES

CCN(CC)C(=O)C1=C(C2=C(C=C1)OCO2)C(=O)O

InChI

InChI=1S/C13H15NO5/c1-3-14(4-2)12(15)8-5-6-9-11(19-7-18-9)10(8)13(16)17/h5-6H,3-4,7H2,1-2H3,(H,16,17)