(1-cyanoindolizin-2-yl)methyl 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 2-(1,3-benzodioxole-5-carbonylamino)acetate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]acetic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 2-(1,3-benzodioxole-5-carbonylamino)acetate Traditional Name: 2-(piperonyloylamino)acetic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C20H15N3O5 MolecularWeight: 377.3502

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NCC(=O)OCC3=CN4C=CC=CC4=C3C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NCC(=O)OCC3=CN4C=CC=CC4=C3C#N

InChI

InChI=1S/C20H15N3O5/c21-8-15-14(10-23-6-2-1-3-16(15)23)11-26-19(24)9-22-20(25)13-4-5-17-18(7-13)28-12-27-17/h1-7,10H,9,11-12H2,(H,22,25)