1-morpholin-4-yl-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanone

Systemtic Name: 1-morpholin-4-yl-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanone Openeye Name: 1-morpholino-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanone CAS Name: 1-(4-morpholinyl)-2-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]ethanone IUPAC Name: 1-morpholin-4-yl-2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)ethanone Traditional Name: 1-morpholino-2-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)ethanone Formula: C16H21N3O7S MolecularWeight: 399.41884

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H21N3O7S/c20-16(17-7-9-25-10-8-17)12-26-15-4-3-13(11-14(15)19(21)22)27(23,24)18-5-1-2-6-18/h3-4,11H,1-2,5-10,12H2