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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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