5-(hydroxymethyl)-1'-methyl-5-nitro-spiro[1,3-dioxane-2,3'-indole]-2'-one

Systemtic Name: 5-(hydroxymethyl)-1'-methyl-5-nitro-spiro[1,3-dioxane-2,3'-indole]-2'-one Openeye Name: 5-(hydroxymethyl)-1'-methyl-5-nitro-spiro[1,3-dioxane-2,3'-indoline]-2'-one CAS Name: 5-(hydroxymethyl)-1'-methyl-5-nitro-2'-spiro[1,3-dioxane-2,3'-indole]one IUPAC Name: 5-(hydroxymethyl)-1'-methyl-5-nitrospiro[1,3-dioxane-2,3'-indole]-2'-one Traditional Name: 1'-methyl-5-methylol-5-nitro-spiro[1,3-dioxane-2,3'-indoline]-2'-one Formula: C13H14N2O6 MolecularWeight: 294.26006

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C3(C1=O)OCC(CO3)(CO)[N+](=O)[O-]

Isomeric SMILES

CN1C2=CC=CC=C2C3(C1=O)OCC(CO3)(CO)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O6/c1-14-10-5-3-2-4-9(10)13(11(14)17)20-7-12(6-16,8-21-13)15(18)19/h2-5,16H,6-8H2,1H3