[(2R)-butan-2-yl] 3,5-dinitrobenzoate

Systemtic Name: [(2R)-butan-2-yl] 3,5-dinitrobenzoate Openeye Name: [(1R)-1-methylpropyl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [(2R)-butan-2-yl] ester IUPAC Name: [(2R)-butan-2-yl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [(1R)-1-methylpropyl] ester Formula: C11H12N2O6 MolecularWeight: 268.22278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O6/c1-3-7(2)19-11(14)8-4-9(12(15)16)6-10(5-8)13(17)18/h4-7H,3H2,1-2H3/t7-/m1/s1