(3-nitrophenyl) 2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoate

Systemtic Name: (3-nitrophenyl) 2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoate Openeye Name: (3-nitrophenyl) 2-(4-bromo-2,6-dimethyl-phenoxy)acetate CAS Name: 2-(4-bromo-2,6-dimethylphenoxy)acetic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 2-(4-bromo-2,6-dimethylphenoxy)acetate Traditional Name: 2-(4-bromo-2,6-dimethyl-phenoxy)acetic acid (3-nitrophenyl) ester Formula: C16H14BrNO5 MolecularWeight: 380.19006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)OC2=CC=CC(=C2)[N+](=O)[O-])C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)OC2=CC=CC(=C2)[N+](=O)[O-])C)Br

InChI

InChI=1S/C16H14BrNO5/c1-10-6-12(17)7-11(2)16(10)22-9-15(19)23-14-5-3-4-13(8-14)18(20)21/h3-8H,9H2,1-2H3