[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate

Systemtic Name: [(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate Openeye Name: [(1R)-2-amino-1-methyl-2-oxo-ethyl] 2-(1,3-benzodioxole-5-carbonylamino)acetate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]acetic acid [(2R)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-amino-1-oxopropan-2-yl] 2-(1,3-benzodioxole-5-carbonylamino)acetate Traditional Name: 2-(piperonyloylamino)acetic acid [(1R)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C13H14N2O6 MolecularWeight: 294.26006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)CNC(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

C[C@H](C(=O)N)OC(=O)CNC(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C13H14N2O6/c1-7(12(14)17)21-11(16)5-15-13(18)8-2-3-9-10(4-8)20-6-19-9/h2-4,7H,5-6H2,1H3,(H2,14,17)(H,15,18)/t7-/m1/s1