1-(bromomethyl)-4-hexoxy-5-methoxy-2-nitro-benzene

Systemtic Name: 1-(bromomethyl)-4-hexoxy-5-methoxy-2-nitro-benzene Openeye Name: 1-(bromomethyl)-4-hexoxy-5-methoxy-2-nitro-benzene CAS Name: 1-(bromomethyl)-4-hexoxy-5-methoxy-2-nitrobenzene IUPAC Name: 1-(bromomethyl)-4-hexoxy-5-methoxy-2-nitrobenzene Traditional Name: 1-(bromomethyl)-4-hexoxy-5-methoxy-2-nitro-benzene Formula: C14H20BrNO4 MolecularWeight: 346.2169

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C(=C1)[N+](=O)[O-])CBr)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C(=C1)[N+](=O)[O-])CBr)OC

InChI

InChI=1S/C14H20BrNO4/c1-3-4-5-6-7-20-14-9-12(16(17)18)11(10-15)8-13(14)19-2/h8-9H,3-7,10H2,1-2H3