4-[4-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methoxy]-3-nitro-phenyl]sulfonylmorpholine

Systemtic Name: 4-[4-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methoxy]-3-nitro-phenyl]sulfonylmorpholine Openeye Name: 4-[4-[(3-isobutyl-1,2,4-oxadiazol-5-yl)methoxy]-3-nitro-phenyl]sulfonylmorpholine CAS Name: 4-[4-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methoxy]-3-nitrophenyl]sulfonylmorpholine IUPAC Name: 4-[4-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methoxy]-3-nitrophenyl]sulfonylmorpholine Traditional Name: 4-[4-[(3-isobutyl-1,2,4-oxadiazol-5-yl)methoxy]-3-nitro-phenyl]sulfonylmorpholine Formula: C17H22N4O7S MolecularWeight: 426.44418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NOC(=N1)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CC1=NOC(=N1)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H22N4O7S/c1-12(2)9-16-18-17(28-19-16)11-27-15-4-3-13(10-14(15)21(22)23)29(24,25)20-5-7-26-8-6-20/h3-4,10,12H,5-9,11H2,1-2H3