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

Systemtic Name: 2-[2-(3-bromophenyl)-5-methyl-1,3-oxazol-4-yl]ethanenitrile Openeye Name: 2-[2-(3-bromophenyl)-5-methyl-oxazol-4-yl]acetonitrile CAS Name: 2-[2-(3-bromophenyl)-5-methyl-4-oxazolyl]acetonitrile IUPAC Name: 2-[2-(3-bromophenyl)-5-methyl-1,3-oxazol-4-yl]acetonitrile Traditional Name: 2-[2-(3-bromophenyl)-5-methyl-oxazol-4-yl]acetonitrile Formula: C12H9BrN2O MolecularWeight: 277.11666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC(=CC=C2)Br)CC#N

Isomeric SMILES

CC1=C(N=C(O1)C2=CC(=CC=C2)Br)CC#N

InChI

InChI=1S/C12H9BrN2O/c1-8-11(5-6-14)15-12(16-8)9-3-2-4-10(13)7-9/h2-4,7H,5H2,1H3