(4-bromanyl-2,6-dimethyl-phenyl) 2-(3-methyl-4-nitro-phenoxy)ethanoate

Systemtic Name: (4-bromanyl-2,6-dimethyl-phenyl) 2-(3-methyl-4-nitro-phenoxy)ethanoate Openeye Name: (4-bromo-2,6-dimethyl-phenyl) 2-(3-methyl-4-nitro-phenoxy)acetate CAS Name: 2-(3-methyl-4-nitrophenoxy)acetic acid (4-bromo-2,6-dimethylphenyl) ester IUPAC Name: (4-bromo-2,6-dimethylphenyl) 2-(3-methyl-4-nitrophenoxy)acetate Traditional Name: 2-(3-methyl-4-nitro-phenoxy)acetic acid (4-bromo-2,6-dimethyl-phenyl) ester Formula: C17H16BrNO5 MolecularWeight: 394.21664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)COC2=CC(=C(C=C2)[N+](=O)[O-])C)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)COC2=CC(=C(C=C2)[N+](=O)[O-])C)C)Br

InChI

InChI=1S/C17H16BrNO5/c1-10-8-14(4-5-15(10)19(21)22)23-9-16(20)24-17-11(2)6-13(18)7-12(17)3/h4-8H,9H2,1-3H3