3,7-dimethyloctyl 3,5-dinitrobenzoate

Systemtic Name: 3,7-dimethyloctyl 3,5-dinitrobenzoate Openeye Name: 3,7-dimethyloctyl 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid 3,7-dimethyloctyl ester IUPAC Name: 3,7-dimethyloctyl 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid 3,7-dimethyloctyl ester Formula: C17H24N2O6 MolecularWeight: 352.38226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O6/c1-12(2)5-4-6-13(3)7-8-25-17(20)14-9-15(18(21)22)11-16(10-14)19(23)24/h9-13H,4-8H2,1-3H3