11-bromanylundecyl 3,5-dinitrobenzoate

Systemtic Name: 11-bromanylundecyl 3,5-dinitrobenzoate Openeye Name: 11-bromoundecyl 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid 11-bromoundecyl ester IUPAC Name: 11-bromoundecyl 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid 11-bromoundecyl ester Formula: C18H25BrN2O6 MolecularWeight: 445.3049

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)OCCCCCCCCCCCBr

Isomeric SMILES

C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)OCCCCCCCCCCCBr

InChI

InChI=1S/C18H25BrN2O6/c19-10-8-6-4-2-1-3-5-7-9-11-27-18(22)15-12-16(20(23)24)14-17(13-15)21(25)26/h12-14H,1-11H2