4-[2-methyl-5-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenyl]sulfonylmorpholine

Systemtic Name: 4-[2-methyl-5-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenyl]sulfonylmorpholine Openeye Name: 4-[2-methyl-5-[(E)-2-(3-methyl-4-nitro-isoxazol-5-yl)vinyl]phenyl]sulfonylmorpholine CAS Name: 4-[2-methyl-5-[(E)-2-(3-methyl-4-nitro-5-isoxazolyl)ethenyl]phenyl]sulfonylmorpholine IUPAC Name: 4-[2-methyl-5-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenyl]sulfonylmorpholine Traditional Name: 4-[2-methyl-5-[(E)-2-(3-methyl-4-nitro-isoxazol-5-yl)vinyl]phenyl]sulfonylmorpholine Formula: C17H19N3O6S MolecularWeight: 393.41426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C=CC2=C(C(=NO2)C)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)/C=C/C2=C(C(=NO2)C)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H19N3O6S/c1-12-3-4-14(5-6-15-17(20(21)22)13(2)18-26-15)11-16(12)27(23,24)19-7-9-25-10-8-19/h3-6,11H,7-10H2,1-2H3/b6-5+