(4-bromanyl-2-chloranyl-6-methyl-phenyl) 4-chloranyl-3-nitro-benzoate

Systemtic Name: (4-bromanyl-2-chloranyl-6-methyl-phenyl) 4-chloranyl-3-nitro-benzoate Openeye Name: (4-bromo-2-chloro-6-methyl-phenyl) 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid (4-bromo-2-chloro-6-methylphenyl) ester IUPAC Name: (4-bromo-2-chloro-6-methylphenyl) 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid (4-bromo-2-chloro-6-methyl-phenyl) ester Formula: C14H8BrCl2NO4 MolecularWeight: 405.02762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H8BrCl2NO4/c1-7-4-9(15)6-11(17)13(7)22-14(19)8-2-3-10(16)12(5-8)18(20)21/h2-6H,1H3