2-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[[3-(4-methoxyphenyl)isoxazol-5-yl]methyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[[3-(4-methoxyphenyl)-5-isoxazolyl]methyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[[3-(4-methoxyphenyl)isoxazol-5-yl]methyl]-4-nitro-isoindoline-1,3-quinone Formula: C19H13N3O6 MolecularWeight: 379.32302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=C2)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=C2)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H13N3O6/c1-27-12-7-5-11(6-8-12)15-9-13(28-20-15)10-21-18(23)14-3-2-4-16(22(25)26)17(14)19(21)24/h2-9H,10H2,1H3