methyl 3-[5-(4-bromophenyl)-1,2-oxazol-4-yl]propanoate

Systemtic Name: methyl 3-[5-(4-bromophenyl)-1,2-oxazol-4-yl]propanoate Openeye Name: methyl 3-[5-(4-bromophenyl)isoxazol-4-yl]propanoate CAS Name: 3-[5-(4-bromophenyl)-4-isoxazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[5-(4-bromophenyl)-1,2-oxazol-4-yl]propanoate Traditional Name: 3-[5-(4-bromophenyl)isoxazol-4-yl]propionic acid methyl ester Formula: C13H12BrNO3 MolecularWeight: 310.14328

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=C(ON=C1)C2=CC=C(C=C2)Br

Isomeric SMILES

COC(=O)CCC1=C(ON=C1)C2=CC=C(C=C2)Br

InChI

InChI=1S/C13H12BrNO3/c1-17-12(16)7-4-10-8-15-18-13(10)9-2-5-11(14)6-3-9/h2-3,5-6,8H,4,7H2,1H3