3-cyanopropyl 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate

Systemtic Name: 3-cyanopropyl 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate Openeye Name: 3-cyanopropyl 2-(1,3-benzodioxole-5-carbonylamino)acetate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]acetic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 2-(1,3-benzodioxole-5-carbonylamino)acetate Traditional Name: 2-(piperonyloylamino)acetic acid 3-cyanopropyl ester Formula: C14H14N2O5 MolecularWeight: 290.27136

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NCC(=O)OCCCC#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NCC(=O)OCCCC#N

InChI

InChI=1S/C14H14N2O5/c15-5-1-2-6-19-13(17)8-16-14(18)10-3-4-11-12(7-10)21-9-20-11/h3-4,7H,1-2,6,8-9H2,(H,16,18)