(4-bromanyl-2-chloranyl-6-methyl-phenyl) 3-nitrobenzoate

Systemtic Name: (4-bromanyl-2-chloranyl-6-methyl-phenyl) 3-nitrobenzoate Openeye Name: (4-bromo-2-chloro-6-methyl-phenyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (4-bromo-2-chloro-6-methylphenyl) ester IUPAC Name: (4-bromo-2-chloro-6-methylphenyl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (4-bromo-2-chloro-6-methyl-phenyl) ester Formula: C14H9BrClNO4 MolecularWeight: 370.58256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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