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

Systemtic Name: 1-[3-(4-chlorophenyl)-5-[(2-nitrophenyl)-oxidanyl-methyl]-4H-1,2-oxazol-5-yl]ethanone Openeye Name: 1-[3-(4-chlorophenyl)-5-[hydroxy-(2-nitrophenyl)methyl]-4H-isoxazol-5-yl]ethanone CAS Name: 1-[3-(4-chlorophenyl)-5-[hydroxy-(2-nitrophenyl)methyl]-4H-isoxazol-5-yl]ethanone IUPAC Name: 1-[3-(4-chlorophenyl)-5-[hydroxy-(2-nitrophenyl)methyl]-4H-1,2-oxazol-5-yl]ethanone Traditional Name: 1-[3-(4-chlorophenyl)-5-[hydroxy-(2-nitrophenyl)methyl]-2-isoxazolin-5-yl]ethanone Formula: C18H15ClN2O5 MolecularWeight: 374.7751

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClN2O5/c1-11(22)18(17(23)14-4-2-3-5-16(14)21(24)25)10-15(20-26-18)12-6-8-13(19)9-7-12/h2-9,17,23H,10H2,1H3