3-[3-[(3-bromophenyl)methyl]-1,2,4-oxadiazol-5-yl]propanoic acid

Systemtic Name: 3-[3-[(3-bromophenyl)methyl]-1,2,4-oxadiazol-5-yl]propanoic acid Openeye Name: 3-[3-[(3-bromophenyl)methyl]-1,2,4-oxadiazol-5-yl]propanoic acid CAS Name: 3-[3-[(3-bromophenyl)methyl]-1,2,4-oxadiazol-5-yl]propanoic acid IUPAC Name: 3-[3-[(3-bromophenyl)methyl]-1,2,4-oxadiazol-5-yl]propanoic acid Traditional Name: 3-[3-(3-bromobenzyl)-1,2,4-oxadiazol-5-yl]propionic acid Formula: C12H11BrN2O3 MolecularWeight: 311.13134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CC2=NOC(=N2)CCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)CC2=NOC(=N2)CCC(=O)O

InChI

InChI=1S/C12H11BrN2O3/c13-9-3-1-2-8(6-9)7-10-14-11(18-15-10)4-5-12(16)17/h1-3,6H,4-5,7H2,(H,16,17)