(1-cyanoindolizin-2-yl)methyl 1,3-benzodioxole-5-carboxylate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 1,3-benzodioxole-5-carboxylate Openeye Name: (1-cyanoindolizin-2-yl)methyl 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C18H12N2O4 MolecularWeight: 320.29888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12N2O4/c19-8-14-13(9-20-6-2-1-3-15(14)20)10-22-18(21)12-4-5-16-17(7-12)24-11-23-16/h1-7,9H,10-11H2