(4-nitrophenyl) 3-bromanyl-2,2-diethoxy-propanoate

Systemtic Name: (4-nitrophenyl) 3-bromanyl-2,2-diethoxy-propanoate Openeye Name: (4-nitrophenyl) 3-bromo-2,2-diethoxy-propanoate CAS Name: 3-bromo-2,2-diethoxypropanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 3-bromo-2,2-diethoxypropanoate Traditional Name: 3-bromo-2,2-diethoxy-propionic acid (4-nitrophenyl) ester Formula: C13H16BrNO6 MolecularWeight: 362.17324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CBr)(C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])OCC

Isomeric SMILES

CCOC(CBr)(C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])OCC

InChI

InChI=1S/C13H16BrNO6/c1-3-19-13(9-14,20-4-2)12(16)21-11-7-5-10(6-8-11)15(17)18/h5-8H,3-4,9H2,1-2H3