4-bromanyl-2,2,4,6,6-pentanitro-heptane

Systemtic Name: 4-bromanyl-2,2,4,6,6-pentanitro-heptane Openeye Name: 4-bromo-2,2,4,6,6-pentanitro-heptane CAS Name: 4-bromo-2,2,4,6,6-pentanitroheptane IUPAC Name: 4-bromo-2,2,4,6,6-pentanitroheptane Traditional Name: 4-bromo-2,2,4,6,6-pentanitro-heptane Formula: C7H10BrN5O10 MolecularWeight: 404.0858

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CC(C)([N+](=O)[O-])[N+](=O)[O-])([N+](=O)[O-])Br)([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(CC(CC(C)([N+](=O)[O-])[N+](=O)[O-])([N+](=O)[O-])Br)([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C7H10BrN5O10/c1-5(9(14)15,10(16)17)3-7(8,13(22)23)4-6(2,11(18)19)12(20)21/h3-4H2,1-2H3