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

Systemtic Name: 1-[5-[(2-nitrophenyl)-oxidanyl-methyl]-3-phenyl-4H-1,2-oxazol-5-yl]ethanone Openeye Name: 1-[5-[hydroxy-(2-nitrophenyl)methyl]-3-phenyl-4H-isoxazol-5-yl]ethanone CAS Name: 1-[5-[hydroxy-(2-nitrophenyl)methyl]-3-phenyl-4H-isoxazol-5-yl]ethanone IUPAC Name: 1-[5-[hydroxy-(2-nitrophenyl)methyl]-3-phenyl-4H-1,2-oxazol-5-yl]ethanone Traditional Name: 1-[5-[hydroxy-(2-nitrophenyl)methyl]-3-phenyl-2-isoxazolin-5-yl]ethanone Formula: C18H16N2O5 MolecularWeight: 340.33004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CC(=NO1)C2=CC=CC=C2)C(C3=CC=CC=C3[N+](=O)[O-])O

Isomeric SMILES

CC(=O)C1(CC(=NO1)C2=CC=CC=C2)C(C3=CC=CC=C3[N+](=O)[O-])O

InChI

InChI=1S/C18H16N2O5/c1-12(21)18(11-15(19-25-18)13-7-3-2-4-8-13)17(22)14-9-5-6-10-16(14)20(23)24/h2-10,17,22H,11H2,1H3