(2S)-2-[1,3-benzodioxol-5-ylmethyl(ethanoyl)amino]propanoate

Systemtic Name: (2S)-2-[1,3-benzodioxol-5-ylmethyl(ethanoyl)amino]propanoate Openeye Name: (2S)-2-[acetyl(1,3-benzodioxol-5-ylmethyl)amino]propanoate CAS Name: (2S)-2-[acetyl(1,3-benzodioxol-5-ylmethyl)amino]propanoate IUPAC Name: (2S)-2-[acetyl(1,3-benzodioxol-5-ylmethyl)amino]propanoate Traditional Name: (2S)-2-[acetyl(piperonyl)amino]propionate Formula: C13H14NO5- MolecularWeight: 264.25396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO5/c1-8(13(16)17)14(9(2)15)6-10-3-4-11-12(5-10)19-7-18-11/h3-5,8H,6-7H2,1-2H3,(H,16,17)/p-1/t8-/m0/s1