(2S)-2-(1,3-benzodioxol-5-ylmethylcarbamoylamino)propanoate

Systemtic Name: (2S)-2-(1,3-benzodioxol-5-ylmethylcarbamoylamino)propanoate Openeye Name: (2S)-2-(1,3-benzodioxol-5-ylmethylcarbamoylamino)propanoate CAS Name: (2S)-2-[[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]amino]propanoate IUPAC Name: (2S)-2-(1,3-benzodioxol-5-ylmethylcarbamoylamino)propanoate Traditional Name: (2S)-2-(piperonylcarbamoylamino)propionate Formula: C12H13N2O5- MolecularWeight: 265.24202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])NC(=O)NCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

C[C@@H](C(=O)[O-])NC(=O)NCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C12H14N2O5/c1-7(11(15)16)14-12(17)13-5-8-2-3-9-10(4-8)19-6-18-9/h2-4,7H,5-6H2,1H3,(H,15,16)(H2,13,14,17)/p-1/t7-/m0/s1