2,3-bis(bromanyl)hept-2-enyl 3,5-dinitrobenzoate

Systemtic Name: 2,3-bis(bromanyl)hept-2-enyl 3,5-dinitrobenzoate Openeye Name: 2,3-dibromohept-2-enyl 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid 2,3-dibromohept-2-enyl ester IUPAC Name: 2,3-dibromohept-2-enyl 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid 2,3-dibromohept-2-enyl ester Formula: C14H14Br2N2O6 MolecularWeight: 466.07876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=C(COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-])Br)Br

Isomeric SMILES

CCCCC(=C(COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-])Br)Br

InChI

InChI=1S/C14H14Br2N2O6/c1-2-3-4-12(15)13(16)8-24-14(19)9-5-10(17(20)21)7-11(6-9)18(22)23/h5-7H,2-4,8H2,1H3