6-methyl-1,2,6-trinitro-cyclohexa-2,4-dien-1-ol

Systemtic Name: 6-methyl-1,2,6-trinitro-cyclohexa-2,4-dien-1-ol Openeye Name: 6-methyl-1,2,6-trinitro-cyclohexa-2,4-dien-1-ol CAS Name: 6-methyl-1,2,6-trinitro-1-cyclohexa-2,4-dienol IUPAC Name: 6-methyl-1,2,6-trinitrocyclohexa-2,4-dien-1-ol Traditional Name: 6-methyl-1,2,6-trinitro-cyclohexa-2,4-dien-1-ol Formula: C7H7N3O7 MolecularWeight: 245.14638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H7N3O7/c1-6(9(14)15)4-2-3-5(8(12)13)7(6,11)10(16)17/h2-4,11H,1H3