(3R,4S)-4-[(5-nitro-2-oxidanyl-phenyl)amino]-1,1-bis(oxidanylidene)thiolan-3-ol

Systemtic Name: (3R,4S)-4-[(5-nitro-2-oxidanyl-phenyl)amino]-1,1-bis(oxidanylidene)thiolan-3-ol Openeye Name: (3R,4S)-4-(2-hydroxy-5-nitro-anilino)-1,1-dioxo-thiolan-3-ol CAS Name: (3R,4S)-4-(2-hydroxy-5-nitroanilino)-1,1-dioxo-3-thiolanol IUPAC Name: (3R,4S)-4-(2-hydroxy-5-nitroanilino)-1,1-dioxothiolan-3-ol Traditional Name: (3R,4S)-4-(2-hydroxy-5-nitro-anilino)-1,1-diketo-thiolan-3-ol Formula: C10H12N2O6S MolecularWeight: 288.27708

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CS1(=O)=O)O)NC2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

C1[C@H]([C@H](CS1(=O)=O)O)NC2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C10H12N2O6S/c13-9-2-1-6(12(15)16)3-7(9)11-8-4-19(17,18)5-10(8)14/h1-3,8,10-11,13-14H,4-5H2/t8-,10+/m1/s1