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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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