N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)acetamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-2-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]acetamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)acetamide Traditional Name: N-(1,1-diketothiolan-3-yl)-2-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)acetamide Formula: C16H21N3O8S2 MolecularWeight: 447.48324

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)NC3CCS(=O)(=O)C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)NC3CCS(=O)(=O)C3)[N+](=O)[O-]

InChI

InChI=1S/C16H21N3O8S2/c20-16(17-12-5-8-28(23,24)11-12)10-27-15-4-3-13(9-14(15)19(21)22)29(25,26)18-6-1-2-7-18/h3-4,9,12H,1-2,5-8,10-11H2,(H,17,20)