2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)-1-(2,4,5-trimethylphenyl)ethanone

Systemtic Name: 2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)-1-(2,4,5-trimethylphenyl)ethanone Openeye Name: 2-(4-morpholinosulfonyl-2-nitro-phenoxy)-1-(2,4,5-trimethylphenyl)ethanone CAS Name: 2-[4-(4-morpholinylsulfonyl)-2-nitrophenoxy]-1-(2,4,5-trimethylphenyl)ethanone IUPAC Name: 2-(4-morpholin-4-ylsulfonyl-2-nitrophenoxy)-1-(2,4,5-trimethylphenyl)ethanone Traditional Name: 2-(4-morpholinosulfonyl-2-nitro-phenoxy)-1-(2,4,5-trimethylphenyl)ethanone Formula: C21H24N2O7S MolecularWeight: 448.48946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-])C)C

InChI

InChI=1S/C21H24N2O7S/c1-14-10-16(3)18(11-15(14)2)20(24)13-30-21-5-4-17(12-19(21)23(25)26)31(27,28)22-6-8-29-9-7-22/h4-5,10-12H,6-9,13H2,1-3H3