(2-methanoyl-4-nitro-phenyl) 3-bromanyl-4-phenethyloxy-benzoate

Systemtic Name: (2-methanoyl-4-nitro-phenyl) 3-bromanyl-4-phenethyloxy-benzoate Openeye Name: (2-formyl-4-nitro-phenyl) 3-bromo-4-phenethyloxy-benzoate CAS Name: 3-bromo-4-phenethyloxybenzoic acid (2-formyl-4-nitrophenyl) ester IUPAC Name: (2-formyl-4-nitrophenyl) 3-bromo-4-phenethyloxybenzoate Traditional Name: 3-bromo-4-phenethyloxy-benzoic acid (2-formyl-4-nitro-phenyl) ester Formula: C22H16BrNO6 MolecularWeight: 470.26954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])C=O)Br

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])C=O)Br

InChI

InChI=1S/C22H16BrNO6/c23-19-13-16(6-8-21(19)29-11-10-15-4-2-1-3-5-15)22(26)30-20-9-7-18(24(27)28)12-17(20)14-25/h1-9,12-14H,10-11H2