(2S)-2-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(ethanoyl)amino]propanoate

Systemtic Name: (2S)-2-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(ethanoyl)amino]propanoate Openeye Name: (2S)-2-[acetyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]propanoate CAS Name: (2S)-2-[acetyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]propanoate IUPAC Name: (2S)-2-[acetyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]propanoate Traditional Name: (2S)-2-[acetyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]propionate Formula: C14H16NO5- MolecularWeight: 278.28054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])N(CC1=CC2=C(C=C1)OCCO2)C(=O)C

Isomeric SMILES

C[C@@H](C(=O)[O-])N(CC1=CC2=C(C=C1)OCCO2)C(=O)C

InChI

InChI=1S/C14H17NO5/c1-9(14(17)18)15(10(2)16)8-11-3-4-12-13(7-11)20-6-5-19-12/h3-4,7,9H,5-6,8H2,1-2H3,(H,17,18)/p-1/t9-/m0/s1