4-[4-(2-methyl-5-propan-2-yl-phenoxy)-3-nitro-phenyl]sulfonylmorpholine

Systemtic Name: 4-[4-(2-methyl-5-propan-2-yl-phenoxy)-3-nitro-phenyl]sulfonylmorpholine Openeye Name: 4-[4-(5-isopropyl-2-methyl-phenoxy)-3-nitro-phenyl]sulfonylmorpholine CAS Name: 4-[4-(2-methyl-5-propan-2-ylphenoxy)-3-nitrophenyl]sulfonylmorpholine IUPAC Name: 4-[4-(2-methyl-5-propan-2-ylphenoxy)-3-nitrophenyl]sulfonylmorpholine Traditional Name: 4-[4-(5-isopropyl-2-methyl-phenoxy)-3-nitro-phenyl]sulfonylmorpholine Formula: C20H24N2O6S MolecularWeight: 420.47936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)C)OC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)C)OC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N2O6S/c1-14(2)16-5-4-15(3)20(12-16)28-19-7-6-17(13-18(19)22(23)24)29(25,26)21-8-10-27-11-9-21/h4-7,12-14H,8-11H2,1-3H3