3-[5-(4-bromophenyl)-1,2,3,4-tetrazol-2-yl]propanenitrile

Systemtic Name: 3-[5-(4-bromophenyl)-1,2,3,4-tetrazol-2-yl]propanenitrile Openeye Name: 3-[5-(4-bromophenyl)tetrazol-2-yl]propanenitrile CAS Name: 3-[5-(4-bromophenyl)-2-tetrazolyl]propanenitrile IUPAC Name: 3-[5-(4-bromophenyl)tetrazol-2-yl]propanenitrile Traditional Name: 3-[5-(4-bromophenyl)tetrazol-2-yl]propionitrile Formula: C10H8BrN5 MolecularWeight: 278.10802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(N=N2)CCC#N)Br

Isomeric SMILES

C1=CC(=CC=C1C2=NN(N=N2)CCC#N)Br

InChI

InChI=1S/C10H8BrN5/c11-9-4-2-8(3-5-9)10-13-15-16(14-10)7-1-6-12/h2-5H,1,7H2