2-[[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]amino]propanoic acid

Systemtic Name: 2-[[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]amino]propanoic acid Openeye Name: 2-[[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]amino]propanoic acid CAS Name: 2-[[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]amino]propanoic acid IUPAC Name: 2-[[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]amino]propanoic acid Traditional Name: 2-[[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]amino]propionic acid Formula: C12H14N2O5 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NCC(=O)NC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C(=O)O)NCC(=O)NC1=CC2=C(C=C1)OCO2

InChI

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