5-(3-bromophenyl)-1H-pyrazole-4-carbonitrile

Systemtic Name: 5-(3-bromophenyl)-1H-pyrazole-4-carbonitrile Openeye Name: 5-(3-bromophenyl)-1H-pyrazole-4-carbonitrile CAS Name: 5-(3-bromophenyl)-1H-pyrazole-4-carbonitrile IUPAC Name: 5-(3-bromophenyl)-1H-pyrazole-4-carbonitrile Traditional Name: 5-(3-bromophenyl)-1H-pyrazole-4-carbonitrile Formula: C10H6BrN3 MolecularWeight: 248.07874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=C(C=NN2)C#N

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=C(C=NN2)C#N

InChI

InChI=1S/C10H6BrN3/c11-9-3-1-2-7(4-9)10-8(5-12)6-13-14-10/h1-4,6H,(H,13,14)