(3-nitrophenyl) 3-bromanyl-4-hexoxy-benzoate

Systemtic Name: (3-nitrophenyl) 3-bromanyl-4-hexoxy-benzoate Openeye Name: (3-nitrophenyl) 3-bromo-4-hexoxy-benzoate CAS Name: 3-bromo-4-hexoxybenzoic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 3-bromo-4-hexoxybenzoate Traditional Name: 3-bromo-4-hexoxy-benzoic acid (3-nitrophenyl) ester Formula: C19H20BrNO5 MolecularWeight: 422.2698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)[N+](=O)[O-])Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C19H20BrNO5/c1-2-3-4-5-11-25-18-10-9-14(12-17(18)20)19(22)26-16-8-6-7-15(13-16)21(23)24/h6-10,12-13H,2-5,11H2,1H3