2-[[5-(4-bromophenyl)-1,2-oxazol-3-yl]-oxidanyl-methyl]prop-2-enoic acid

Systemtic Name: 2-[[5-(4-bromophenyl)-1,2-oxazol-3-yl]-oxidanyl-methyl]prop-2-enoic acid Openeye Name: 2-[[5-(4-bromophenyl)isoxazol-3-yl]-hydroxy-methyl]prop-2-enoic acid CAS Name: 2-[[5-(4-bromophenyl)-3-isoxazolyl]-hydroxymethyl]-2-propenoic acid IUPAC Name: 2-[[5-(4-bromophenyl)-1,2-oxazol-3-yl]-hydroxymethyl]prop-2-enoic acid Traditional Name: 2-[[5-(4-bromophenyl)isoxazol-3-yl]-hydroxy-methyl]acrylic acid Formula: C13H10BrNO4 MolecularWeight: 324.1268

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(C1=NOC(=C1)C2=CC=C(C=C2)Br)O)C(=O)O

Isomeric SMILES

C=C(C(C1=NOC(=C1)C2=CC=C(C=C2)Br)O)C(=O)O

InChI

InChI=1S/C13H10BrNO4/c1-7(13(17)18)12(16)10-6-11(19-15-10)8-2-4-9(14)5-3-8/h2-6,12,16H,1H2,(H,17,18)