N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-N-methyl-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-N-methyl-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-N-methyl-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-(1,1-diketothiolan-3-yl)-N-methyl-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C14H16N2O7S MolecularWeight: 356.35104

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3

Isomeric SMILES

CN(C1CCS(=O)(=O)C1)C(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3

InChI

InChI=1S/C14H16N2O7S/c1-15(9-2-5-24(20,21)8-9)14(17)10-6-12-13(23-4-3-22-12)7-11(10)16(18)19/h6-7,9H,2-5,8H2,1H3