(3R,4S)-3-methyl-N-(4-methylphenyl)-4-nitro-1,1-bis(oxidanylidene)thiolan-3-amine

Systemtic Name: (3R,4S)-3-methyl-N-(4-methylphenyl)-4-nitro-1,1-bis(oxidanylidene)thiolan-3-amine Openeye Name: (3R,4S)-3-methyl-4-nitro-1,1-dioxo-N-(p-tolyl)thiolan-3-amine CAS Name: (3R,4S)-3-methyl-N-(4-methylphenyl)-4-nitro-1,1-dioxo-3-thiolanamine IUPAC Name: (3R,4S)-3-methyl-N-(4-methylphenyl)-4-nitro-1,1-dioxothiolan-3-amine Traditional Name: [(3R,4S)-1,1-diketo-3-methyl-4-nitro-thiolan-3-yl]-(p-tolyl)amine Formula: C12H16N2O4S MolecularWeight: 284.33144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2(CS(=O)(=O)CC2[N+](=O)[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O4S/c1-9-3-5-10(6-4-9)13-12(2)8-19(17,18)7-11(12)14(15)16/h3-6,11,13H,7-8H2,1-2H3/t11-,12+/m1/s1