1,3-benzodioxol-5-yl 3-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate

Systemtic Name: 1,3-benzodioxol-5-yl 3-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate Openeye Name: 1,3-benzodioxol-5-yl 3-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 3-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate Traditional Name: 3-(3-p-phenetyl-1,2,4-oxadiazol-5-yl)propionic acid 1,3-benzodioxol-5-yl ester Formula: C20H18N2O6 MolecularWeight: 382.36672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H18N2O6/c1-2-24-14-5-3-13(4-6-14)20-21-18(28-22-20)9-10-19(23)27-15-7-8-16-17(11-15)26-12-25-16/h3-8,11H,2,9-10,12H2,1H3