2-acetamido-3-(1,3-benzodioxol-5-yl)-2-methyl-propanoic acid

Systemtic Name: 2-acetamido-3-(1,3-benzodioxol-5-yl)-2-methyl-propanoic acid Openeye Name: 2-acetamido-3-(1,3-benzodioxol-5-yl)-2-methyl-propanoic acid CAS Name: 2-acetamido-3-(1,3-benzodioxol-5-yl)-2-methylpropanoic acid IUPAC Name: 2-acetamido-3-(1,3-benzodioxol-5-yl)-2-methylpropanoic acid Traditional Name: 2-acetamido-3-(1,3-benzodioxol-5-yl)-2-methyl-propionic acid Formula: C13H15NO5 MolecularWeight: 265.2619

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C)(CC1=CC2=C(C=C1)OCO2)C(=O)O

Isomeric SMILES

CC(=O)NC(C)(CC1=CC2=C(C=C1)OCO2)C(=O)O

InChI

InChI=1S/C13H15NO5/c1-8(15)14-13(2,12(16)17)6-9-3-4-10-11(5-9)19-7-18-10/h3-5H,6-7H2,1-2H3,(H,14,15)(H,16,17)