[2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate Openeye Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 2-(1,3-benzodioxole-5-carbonylamino)acetate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]acetic acid [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 2-(1,3-benzodioxole-5-carbonylamino)acetate Traditional Name: 2-(piperonyloylamino)acetic acid [2-keto-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)COC(=O)CNC(=O)C1=CC2=C(C=C1)OCO2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CNC(=O)COC(=O)CNC(=O)C1=CC2=C(C=C1)OCO2)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O6/c1-14(15-5-3-2-4-6-15)10-22-19(24)12-27-20(25)11-23-21(26)16-7-8-17-18(9-16)29-13-28-17/h2-9,14H,10-13H2,1H3,(H,22,24)(H,23,26)/t14-/m1/s1