2-[[5-(4-bromophenyl)-1,2-oxazol-3-yl]-oxidanyl-methyl]cyclohex-2-en-1-one

Systemtic Name: 2-[[5-(4-bromophenyl)-1,2-oxazol-3-yl]-oxidanyl-methyl]cyclohex-2-en-1-one Openeye Name: 2-[[5-(4-bromophenyl)isoxazol-3-yl]-hydroxy-methyl]cyclohex-2-en-1-one CAS Name: 2-[[5-(4-bromophenyl)-3-isoxazolyl]-hydroxymethyl]-1-cyclohex-2-enone IUPAC Name: 2-[[5-(4-bromophenyl)-1,2-oxazol-3-yl]-hydroxymethyl]cyclohex-2-en-1-one Traditional Name: 2-[[5-(4-bromophenyl)isoxazol-3-yl]-hydroxy-methyl]cyclohex-2-en-1-one Formula: C16H14BrNO3 MolecularWeight: 348.19126

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C(C(=O)C1)C(C2=NOC(=C2)C3=CC=C(C=C3)Br)O

Isomeric SMILES

C1CC=C(C(=O)C1)C(C2=NOC(=C2)C3=CC=C(C=C3)Br)O

InChI

InChI=1S/C16H14BrNO3/c17-11-7-5-10(6-8-11)15-9-13(18-21-15)16(20)12-3-1-2-4-14(12)19/h3,5-9,16,20H,1-2,4H2