N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N,4-dimethyl-3-nitro-benzamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N,4-dimethyl-3-nitro-benzamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N,4-dimethyl-3-nitro-benzamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-N,4-dimethyl-3-nitrobenzamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N,4-dimethyl-3-nitrobenzamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-N,4-dimethyl-3-nitro-benzamide Formula: C13H16N2O5S MolecularWeight: 312.34154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(C)C2CCS(=O)(=O)C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(C)[C@H]2CCS(=O)(=O)C2)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O5S/c1-9-3-4-10(7-12(9)15(17)18)13(16)14(2)11-5-6-21(19,20)8-11/h3-4,7,11H,5-6,8H2,1-2H3/t11-/m0/s1