2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)-1-(3,4,5-trimethoxyphenyl)ethanone

Systemtic Name: 2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)-1-(3,4,5-trimethoxyphenyl)ethanone Openeye Name: 2-(4-morpholinosulfonyl-2-nitro-phenoxy)-1-(3,4,5-trimethoxyphenyl)ethanone CAS Name: 2-[4-(4-morpholinylsulfonyl)-2-nitrophenoxy]-1-(3,4,5-trimethoxyphenyl)ethanone IUPAC Name: 2-(4-morpholin-4-ylsulfonyl-2-nitrophenoxy)-1-(3,4,5-trimethoxyphenyl)ethanone Traditional Name: 2-(4-morpholinosulfonyl-2-nitro-phenoxy)-1-(3,4,5-trimethoxyphenyl)ethanone Formula: C21H24N2O10S MolecularWeight: 496.48766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N2O10S/c1-29-19-10-14(11-20(30-2)21(19)31-3)17(24)13-33-18-5-4-15(12-16(18)23(25)26)34(27,28)22-6-8-32-9-7-22/h4-5,10-12H,6-9,13H2,1-3H3