2-(1,3-benzodioxol-5-ylcarbonylamino)-3,3-dimethyl-butanoic acid

Systemtic Name: 2-(1,3-benzodioxol-5-ylcarbonylamino)-3,3-dimethyl-butanoic acid Openeye Name: 2-(1,3-benzodioxole-5-carbonylamino)-3,3-dimethyl-butanoic acid CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-3,3-dimethylbutanoic acid IUPAC Name: 2-(1,3-benzodioxole-5-carbonylamino)-3,3-dimethylbutanoic acid Traditional Name: 3,3-dimethyl-2-(piperonyloylamino)butyric acid Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)O)NC(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C)(C)C(C(=O)O)NC(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C14H17NO5/c1-14(2,3)11(13(17)18)15-12(16)8-4-5-9-10(6-8)20-7-19-9/h4-6,11H,7H2,1-3H3,(H,15,16)(H,17,18)