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

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-ethyl-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-N-ethyl-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)acetamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-N-ethyl-2-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]acetamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-N-ethyl-2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)acetamide Traditional Name: N-(1,1-diketothiolan-3-yl)-N-ethyl-2-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)acetamide Formula: C18H25N3O8S2 MolecularWeight: 475.5364

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCS(=O)(=O)C1)C(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CCN(C1CCS(=O)(=O)C1)C(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H25N3O8S2/c1-2-20(14-7-10-30(25,26)13-14)18(22)12-29-17-6-5-15(11-16(17)21(23)24)31(27,28)19-8-3-4-9-19/h5-6,11,14H,2-4,7-10,12-13H2,1H3