1-methyl-2,4,6-trinitro-cyclohexane-1,3,5-triol

Systemtic Name: 1-methyl-2,4,6-trinitro-cyclohexane-1,3,5-triol Openeye Name: 1-methyl-2,4,6-trinitro-cyclohexane-1,3,5-triol CAS Name: 1-methyl-2,4,6-trinitrocyclohexane-1,3,5-triol IUPAC Name: 1-methyl-2,4,6-trinitrocyclohexane-1,3,5-triol Traditional Name: 1-methyl-2,4,6-trinitro-cyclohexane-1,3,5-triol Formula: C7H11N3O9 MolecularWeight: 281.17694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H11N3O9/c1-7(13)5(9(16)17)3(11)2(8(14)15)4(12)6(7)10(18)19/h2-6,11-13H,1H3