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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)ethanamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-2-(4-morpholinosulfonyl-2-nitro-phenoxy)acetamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-2-[4-(4-morpholinylsulfonyl)-2-nitrophenoxy]acetamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-2-(4-morpholin-4-ylsulfonyl-2-nitrophenoxy)acetamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-2-(4-morpholinosulfonyl-2-nitro-phenoxy)acetamide Formula: C16H21N3O9S2 MolecularWeight: 463.48264

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H21N3O9S2/c20-16(17-12-3-8-29(23,24)11-12)10-28-15-2-1-13(9-14(15)19(21)22)30(25,26)18-4-6-27-7-5-18/h1-2,9,12H,3-8,10-11H2,(H,17,20)/t12-/m0/s1