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

Systemtic Name: (3S,4R)-4-[(4-methyl-2-nitro-phenyl)amino]-1,1-bis(oxidanylidene)thiolan-3-ol Openeye Name: (3S,4R)-4-(4-methyl-2-nitro-anilino)-1,1-dioxo-thiolan-3-ol CAS Name: (3S,4R)-4-(4-methyl-2-nitroanilino)-1,1-dioxo-3-thiolanol IUPAC Name: (3S,4R)-4-(4-methyl-2-nitroanilino)-1,1-dioxothiolan-3-ol Traditional Name: (3S,4R)-1,1-diketo-4-(4-methyl-2-nitro-anilino)thiolan-3-ol Formula: C11H14N2O5S MolecularWeight: 286.30426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2CS(=O)(=O)CC2O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)N[C@H]2CS(=O)(=O)C[C@H]2O)[N+](=O)[O-]

InChI

InChI=1S/C11H14N2O5S/c1-7-2-3-8(10(4-7)13(15)16)12-9-5-19(17,18)6-11(9)14/h2-4,9,11-12,14H,5-6H2,1H3/t9-,11+/m0/s1