2-[5-methyl-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]-5-(phenylmethyl)-1,3,4-oxadiazole

Systemtic Name: 2-[5-methyl-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]-5-(phenylmethyl)-1,3,4-oxadiazole Openeye Name: 2-benzyl-5-[5-methyl-3-(4-nitrophenyl)-4H-isoxazol-5-yl]-1,3,4-oxadiazole CAS Name: 2-[5-methyl-3-(4-nitrophenyl)-4H-isoxazol-5-yl]-5-(phenylmethyl)-1,3,4-oxadiazole IUPAC Name: 2-benzyl-5-[5-methyl-3-(4-nitrophenyl)-4H-1,2-oxazol-5-yl]-1,3,4-oxadiazole Traditional Name: 2-benzyl-5-[5-methyl-3-(4-nitrophenyl)-2-isoxazolin-5-yl]-1,3,4-oxadiazole Formula: C19H16N4O4 MolecularWeight: 364.35474

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=NO1)C2=CC=C(C=C2)[N+](=O)[O-])C3=NN=C(O3)CC4=CC=CC=C4

Isomeric SMILES

CC1(CC(=NO1)C2=CC=C(C=C2)[N+](=O)[O-])C3=NN=C(O3)CC4=CC=CC=C4

InChI

InChI=1S/C19H16N4O4/c1-19(18-21-20-17(26-18)11-13-5-3-2-4-6-13)12-16(22-27-19)14-7-9-15(10-8-14)23(24)25/h2-10H,11-12H2,1H3