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

Systemtic Name: (2R)-2-acetamido-3-(1,3-benzodioxol-5-yl)propanoic acid Openeye Name: (2R)-2-acetamido-3-(1,3-benzodioxol-5-yl)propanoic acid CAS Name: (2R)-2-acetamido-3-(1,3-benzodioxol-5-yl)propanoic acid IUPAC Name: (2R)-2-acetamido-3-(1,3-benzodioxol-5-yl)propanoic acid Traditional Name: (2R)-2-acetamido-3-(1,3-benzodioxol-5-yl)propionic acid Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)N[C@H](CC1=CC2=C(C=C1)OCO2)C(=O)O

InChI

InChI=1S/C12H13NO5/c1-7(14)13-9(12(15)16)4-8-2-3-10-11(5-8)18-6-17-10/h2-3,5,9H,4,6H2,1H3,(H,13,14)(H,15,16)/t9-/m1/s1