(2-butan-2-yl-4-nitro-phenyl) N-methyl-N-nitro-carbamate

Systemtic Name: (2-butan-2-yl-4-nitro-phenyl) N-methyl-N-nitro-carbamate Openeye Name: (4-nitro-2-sec-butyl-phenyl) N-methyl-N-nitro-carbamate CAS Name: N-methyl-N-nitrocarbamic acid (2-butan-2-yl-4-nitrophenyl) ester IUPAC Name: (2-butan-2-yl-4-nitrophenyl) N-methyl-N-nitrocarbamate Traditional Name: N-methyl-N-nitro-carbamic acid (4-nitro-2-sec-butyl-phenyl) ester Formula: C12H15N3O6 MolecularWeight: 297.264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O6/c1-4-8(2)10-7-9(14(17)18)5-6-11(10)21-12(16)13(3)15(19)20/h5-8H,4H2,1-3H3