N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N,2-dimethyl-3-nitro-benzamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N,2-dimethyl-3-nitro-benzamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-N,2-dimethyl-3-nitro-benzamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-N,2-dimethyl-3-nitrobenzamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-N,2-dimethyl-3-nitrobenzamide Traditional Name: N-(1,1-diketothiolan-3-yl)-N,2-dimethyl-3-nitro-benzamide Formula: C13H16N2O5S MolecularWeight: 312.34154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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