(5-phenyl-1,2-oxazol-3-yl)methyl 3-bromanylbenzoate

Systemtic Name: (5-phenyl-1,2-oxazol-3-yl)methyl 3-bromanylbenzoate Openeye Name: (5-phenylisoxazol-3-yl)methyl 3-bromobenzoate CAS Name: 3-bromobenzoic acid (5-phenyl-3-isoxazolyl)methyl ester IUPAC Name: (5-phenyl-1,2-oxazol-3-yl)methyl 3-bromobenzoate Traditional Name: 3-bromobenzoic acid (5-phenylisoxazol-3-yl)methyl ester Formula: C17H12BrNO3 MolecularWeight: 358.18608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NO2)COC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NO2)COC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H12BrNO3/c18-14-8-4-7-13(9-14)17(20)21-11-15-10-16(22-19-15)12-5-2-1-3-6-12/h1-10H,11H2