[3-(1-morpholin-4-yl-1-oxidanylidene-propan-2-yl)oxy-4-nitro-phenyl]methyl methanesulfonate

Systemtic Name: [3-(1-morpholin-4-yl-1-oxidanylidene-propan-2-yl)oxy-4-nitro-phenyl]methyl methanesulfonate Openeye Name: [3-(1-methyl-2-morpholino-2-oxo-ethoxy)-4-nitro-phenyl]methyl methanesulfonate CAS Name: methanesulfonic acid [3-[1-(4-morpholinyl)-1-oxopropan-2-yl]oxy-4-nitrophenyl]methyl ester IUPAC Name: [3-(1-morpholin-4-yl-1-oxopropan-2-yl)oxy-4-nitrophenyl]methyl methanesulfonate Traditional Name: methanesulfonic acid [3-(2-keto-1-methyl-2-morpholino-ethoxy)-4-nitro-benzyl] ester Formula: C15H20N2O8S MolecularWeight: 388.3929

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCOCC1)OC2=C(C=CC(=C2)COS(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)N1CCOCC1)OC2=C(C=CC(=C2)COS(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O8S/c1-11(15(18)16-5-7-23-8-6-16)25-14-9-12(10-24-26(2,21)22)3-4-13(14)17(19)20/h3-4,9,11H,5-8,10H2,1-2H3