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

Systemtic Name: (2-nitrophenyl) 3-bromanyl-4-hexoxy-benzoate Openeye Name: (2-nitrophenyl) 3-bromo-4-hexoxy-benzoate CAS Name: 3-bromo-4-hexoxybenzoic acid (2-nitrophenyl) ester IUPAC Name: (2-nitrophenyl) 3-bromo-4-hexoxybenzoate Traditional Name: 3-bromo-4-hexoxy-benzoic acid (2-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/c1-2-3-4-7-12-25-17-11-10-14(13-15(17)20)19(22)26-18-9-6-5-8-16(18)21(23)24/h5-6,8-11,13H,2-4,7,12H2,1H3