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

Systemtic Name: [(1R)-2-azanyl-2-oxidanylidene-1-phenyl-ethyl] 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate Openeye Name: [(1R)-2-amino-2-oxo-1-phenyl-ethyl] 2-(1,3-benzodioxole-5-carbonylamino)acetate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]acetic acid [(1R)-2-amino-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-amino-2-oxo-1-phenylethyl] 2-(1,3-benzodioxole-5-carbonylamino)acetate Traditional Name: 2-(piperonyloylamino)acetic acid [(1R)-2-amino-2-keto-1-phenyl-ethyl] ester Formula: C18H16N2O6 MolecularWeight: 356.32944

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NCC(=O)OC(C3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NCC(=O)O[C@H](C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C18H16N2O6/c19-17(22)16(11-4-2-1-3-5-11)26-15(21)9-20-18(23)12-6-7-13-14(8-12)25-10-24-13/h1-8,16H,9-10H2,(H2,19,22)(H,20,23)/t16-/m1/s1