3-(3-bromophenyl)-1,2-oxazole-5-carbonitrile

Systemtic Name: 3-(3-bromophenyl)-1,2-oxazole-5-carbonitrile Openeye Name: 3-(3-bromophenyl)isoxazole-5-carbonitrile CAS Name: 3-(3-bromophenyl)-5-isoxazolecarbonitrile IUPAC Name: 3-(3-bromophenyl)-1,2-oxazole-5-carbonitrile Traditional Name: 3-(3-bromophenyl)isoxazole-5-carbonitrile Formula: C10H5BrN2O MolecularWeight: 249.0635

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=NOC(=C2)C#N

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=NOC(=C2)C#N

InChI

InChI=1S/C10H5BrN2O/c11-8-3-1-2-7(4-8)10-5-9(6-12)14-13-10/h1-5H