methyl [2-(6-methylheptyl)-4,6-dinitro-phenyl] carbonate

Systemtic Name: methyl [2-(6-methylheptyl)-4,6-dinitro-phenyl] carbonate Openeye Name: methyl [2-(6-methylheptyl)-4,6-dinitro-phenyl] carbonate CAS Name: carbonic acid methyl [2-(6-methylheptyl)-4,6-dinitrophenyl] ester IUPAC Name: methyl [2-(6-methylheptyl)-4,6-dinitrophenyl] carbonate Traditional Name: carbonic acid methyl [2-(6-methylheptyl)-4,6-dinitro-phenyl] ester Formula: C16H22N2O7 MolecularWeight: 354.35508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCC1=CC(=CC(=C1OC(=O)OC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)CCCCCC1=CC(=CC(=C1OC(=O)OC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H22N2O7/c1-11(2)7-5-4-6-8-12-9-13(17(20)21)10-14(18(22)23)15(12)25-16(19)24-3/h9-11H,4-8H2,1-3H3