2,2-bis(methoxymethyl)-N-methyl-6-nitro-3-oxidanyl-3,4-dihydrochromene-4-carbothioamide

Systemtic Name: 2,2-bis(methoxymethyl)-N-methyl-6-nitro-3-oxidanyl-3,4-dihydrochromene-4-carbothioamide Openeye Name: 3-hydroxy-2,2-bis(methoxymethyl)-N-methyl-6-nitro-chromane-4-carbothioamide CAS Name: 3-hydroxy-2,2-bis(methoxymethyl)-N-methyl-6-nitro-3,4-dihydro-2H-1-benzopyran-4-carbothioamide IUPAC Name: 3-hydroxy-2,2-bis(methoxymethyl)-N-methyl-6-nitro-3,4-dihydrochromene-4-carbothioamide Traditional Name: 3-hydroxy-2,2-bis(methoxymethyl)-N-methyl-6-nitro-chroman-4-carbothioamide Formula: C15H20N2O6S MolecularWeight: 356.3941

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)C1C(C(OC2=C1C=C(C=C2)[N+](=O)[O-])(COC)COC)O

Isomeric SMILES

CNC(=S)C1C(C(OC2=C1C=C(C=C2)[N+](=O)[O-])(COC)COC)O

InChI

InChI=1S/C15H20N2O6S/c1-16-14(24)12-10-6-9(17(19)20)4-5-11(10)23-15(7-21-2,8-22-3)13(12)18/h4-6,12-13,18H,7-8H2,1-3H3,(H,16,24)