(5-chloranyl-3-ethanoyl-2-oxidanyl-phenyl)methyl 4-bromanylbenzoate

Systemtic Name: (5-chloranyl-3-ethanoyl-2-oxidanyl-phenyl)methyl 4-bromanylbenzoate Openeye Name: (3-acetyl-5-chloro-2-hydroxy-phenyl)methyl 4-bromobenzoate CAS Name: 4-bromobenzoic acid (3-acetyl-5-chloro-2-hydroxyphenyl)methyl ester IUPAC Name: (3-acetyl-5-chloro-2-hydroxyphenyl)methyl 4-bromobenzoate Traditional Name: 4-bromobenzoic acid (3-acetyl-5-chloro-2-hydroxy-benzyl) ester Formula: C16H12BrClO4 MolecularWeight: 383.62108

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC(=C1O)COC(=O)C2=CC=C(C=C2)Br)Cl

Isomeric SMILES

CC(=O)C1=CC(=CC(=C1O)COC(=O)C2=CC=C(C=C2)Br)Cl

InChI

InChI=1S/C16H12BrClO4/c1-9(19)14-7-13(18)6-11(15(14)20)8-22-16(21)10-2-4-12(17)5-3-10/h2-7,20H,8H2,1H3