(2-oxidanylidene-2-propan-2-yloxy-ethyl) 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]ethanoate

Systemtic Name: (2-oxidanylidene-2-propan-2-yloxy-ethyl) 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]ethanoate Openeye Name: (2-isopropoxy-2-oxo-ethyl) 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]acetate CAS Name: 2-[[4-(dimethylamino)-3-nitrophenyl]sulfonylamino]acetic acid (2-oxo-2-propan-2-yloxyethyl) ester IUPAC Name: (2-oxo-2-propan-2-yloxyethyl) 2-[[4-(dimethylamino)-3-nitrophenyl]sulfonylamino]acetate Traditional Name: 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]acetic acid (2-isopropoxy-2-keto-ethyl) ester Formula: C15H21N3O8S MolecularWeight: 403.40754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)COC(=O)CNS(=O)(=O)C1=CC(=C(C=C1)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC(=O)COC(=O)CNS(=O)(=O)C1=CC(=C(C=C1)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O8S/c1-10(2)26-15(20)9-25-14(19)8-16-27(23,24)11-5-6-12(17(3)4)13(7-11)18(21)22/h5-7,10,16H,8-9H2,1-4H3