[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 1,3-benzodioxole-5-carboxylate

Systemtic Name: [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 1,3-benzodioxole-5-carboxylate Openeye Name: [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C18H14N2O6 MolecularWeight: 354.31356

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NOC(=N2)COC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NOC(=N2)COC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H14N2O6/c1-22-13-4-2-3-11(7-13)17-19-16(26-20-17)9-23-18(21)12-5-6-14-15(8-12)25-10-24-14/h2-8H,9-10H2,1H3