N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-methoxy-N-methyl-5-nitro-benzamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-methoxy-N-methyl-5-nitro-benzamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-2-methoxy-N-methyl-5-nitro-benzamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-2-methoxy-N-methyl-5-nitrobenzamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-2-methoxy-N-methyl-5-nitrobenzamide Traditional Name: N-(1,1-diketothiolan-3-yl)-2-methoxy-N-methyl-5-nitro-benzamide Formula: C13H16N2O6S MolecularWeight: 328.34094

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CN(C1CCS(=O)(=O)C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C13H16N2O6S/c1-14(10-5-6-22(19,20)8-10)13(16)11-7-9(15(17)18)3-4-12(11)21-2/h3-4,7,10H,5-6,8H2,1-2H3