(2,2-diethoxycyclohexyl) 3,5-dinitrobenzoate

Systemtic Name: (2,2-diethoxycyclohexyl) 3,5-dinitrobenzoate Openeye Name: (2,2-diethoxycyclohexyl) 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (2,2-diethoxycyclohexyl) ester IUPAC Name: (2,2-diethoxycyclohexyl) 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (2,2-diethoxycyclohexyl) ester Formula: C17H22N2O8 MolecularWeight: 382.36518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1(CCCCC1OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])OCC

Isomeric SMILES

CCOC1(CCCCC1OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])OCC

InChI

InChI=1S/C17H22N2O8/c1-3-25-17(26-4-2)8-6-5-7-15(17)27-16(20)12-9-13(18(21)22)11-14(10-12)19(23)24/h9-11,15H,3-8H2,1-2H3