1-[(4R,5R)-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazol-4-yl]ethanone

Systemtic Name: 1-[(4R,5R)-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazol-4-yl]ethanone Openeye Name: 1-[(4R,5R)-5-(4-nitrophenyl)-3-phenyl-4,5-dihydroisoxazol-4-yl]ethanone CAS Name: 1-[(4R,5R)-5-(4-nitrophenyl)-3-phenyl-4,5-dihydroisoxazol-4-yl]ethanone IUPAC Name: 1-[(4R,5R)-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazol-4-yl]ethanone Traditional Name: 1-[(4R,5R)-5-(4-nitrophenyl)-3-phenyl-2-isoxazolin-4-yl]ethanone Formula: C17H14N2O4 MolecularWeight: 310.30406

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(ON=C1C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)[C@H]1[C@@H](ON=C1C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O4/c1-11(20)15-16(12-5-3-2-4-6-12)18-23-17(15)13-7-9-14(10-8-13)19(21)22/h2-10,15,17H,1H3/t15-,17+/m1/s1