[3-(2-methoxyphenyl)-1,2-oxazol-5-yl]methyl 6-nitro-1,3-benzodioxole-5-carboxylate

Systemtic Name: [3-(2-methoxyphenyl)-1,2-oxazol-5-yl]methyl 6-nitro-1,3-benzodioxole-5-carboxylate Openeye Name: [3-(2-methoxyphenyl)isoxazol-5-yl]methyl 6-nitro-1,3-benzodioxole-5-carboxylate CAS Name: 6-nitro-1,3-benzodioxole-5-carboxylic acid [3-(2-methoxyphenyl)-5-isoxazolyl]methyl ester IUPAC Name: [3-(2-methoxyphenyl)-1,2-oxazol-5-yl]methyl 6-nitro-1,3-benzodioxole-5-carboxylate Traditional Name: 6-nitro-piperonylic acid [3-(2-methoxyphenyl)isoxazol-5-yl]methyl ester Formula: C19H14N2O8 MolecularWeight: 398.32306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NOC(=C2)COC(=O)C3=CC4=C(C=C3[N+](=O)[O-])OCO4

Isomeric SMILES

COC1=CC=CC=C1C2=NOC(=C2)COC(=O)C3=CC4=C(C=C3[N+](=O)[O-])OCO4

InChI

InChI=1S/C19H14N2O8/c1-25-16-5-3-2-4-12(16)14-6-11(29-20-14)9-26-19(22)13-7-17-18(28-10-27-17)8-15(13)21(23)24/h2-8H,9-10H2,1H3