3-azanyl-3-(1,3-benzodioxol-5-yl)-2,2-dimethyl-propanoic acid

Systemtic Name: 3-azanyl-3-(1,3-benzodioxol-5-yl)-2,2-dimethyl-propanoic acid Openeye Name: 3-amino-3-(1,3-benzodioxol-5-yl)-2,2-dimethyl-propanoic acid CAS Name: 3-amino-3-(1,3-benzodioxol-5-yl)-2,2-dimethylpropanoic acid IUPAC Name: 3-amino-3-(1,3-benzodioxol-5-yl)-2,2-dimethylpropanoic acid Traditional Name: 3-amino-3-(1,3-benzodioxol-5-yl)-2,2-dimethyl-propionic acid Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO4/c1-12(2,11(14)15)10(13)7-3-4-8-9(5-7)17-6-16-8/h3-5,10H,6,13H2,1-2H3,(H,14,15)