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

Systemtic Name: (2-bromanyl-4-ethyl-phenyl) 4-chloranyl-3-nitro-benzoate Openeye Name: (2-bromo-4-ethyl-phenyl) 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid (2-bromo-4-ethylphenyl) ester IUPAC Name: (2-bromo-4-ethylphenyl) 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid (2-bromo-4-ethyl-phenyl) ester Formula: C15H11BrClNO4 MolecularWeight: 384.60914

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])Br

InChI

InChI=1S/C15H11BrClNO4/c1-2-9-3-6-14(11(16)7-9)22-15(19)10-4-5-12(17)13(8-10)18(20)21/h3-8H,2H2,1H3