1-[3-(4-methylphenyl)-5-[(2-nitrophenyl)-oxidanyl-methyl]-4H-1,2-oxazol-5-yl]ethanone

Systemtic Name: 1-[3-(4-methylphenyl)-5-[(2-nitrophenyl)-oxidanyl-methyl]-4H-1,2-oxazol-5-yl]ethanone Openeye Name: 1-[5-[hydroxy-(2-nitrophenyl)methyl]-3-(p-tolyl)-4H-isoxazol-5-yl]ethanone CAS Name: 1-[5-[hydroxy-(2-nitrophenyl)methyl]-3-(4-methylphenyl)-4H-isoxazol-5-yl]ethanone IUPAC Name: 1-[5-[hydroxy-(2-nitrophenyl)methyl]-3-(4-methylphenyl)-4H-1,2-oxazol-5-yl]ethanone Traditional Name: 1-[5-[hydroxy-(2-nitrophenyl)methyl]-3-(p-tolyl)-2-isoxazolin-5-yl]ethanone Formula: C19H18N2O5 MolecularWeight: 354.35662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(C2)(C(C3=CC=CC=C3[N+](=O)[O-])O)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(C2)(C(C3=CC=CC=C3[N+](=O)[O-])O)C(=O)C

InChI

InChI=1S/C19H18N2O5/c1-12-7-9-14(10-8-12)16-11-19(13(2)22,26-20-16)18(23)15-5-3-4-6-17(15)21(24)25/h3-10,18,23H,11H2,1-2H3