(2-bromanyl-4-methyl-phenyl) 2-chloranyl-5-nitro-benzoate

Systemtic Name: (2-bromanyl-4-methyl-phenyl) 2-chloranyl-5-nitro-benzoate Openeye Name: (2-bromo-4-methyl-phenyl) 2-chloro-5-nitro-benzoate CAS Name: 2-chloro-5-nitrobenzoic acid (2-bromo-4-methylphenyl) ester IUPAC Name: (2-bromo-4-methylphenyl) 2-chloro-5-nitrobenzoate Traditional Name: 2-chloro-5-nitro-benzoic acid (2-bromo-4-methyl-phenyl) ester Formula: C14H9BrClNO4 MolecularWeight: 370.58256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)Br

InChI

InChI=1S/C14H9BrClNO4/c1-8-2-5-13(11(15)6-8)21-14(18)10-7-9(17(19)20)3-4-12(10)16/h2-7H,1H3