2-(3-bromanyl-4-pyrazol-1-yl-phenyl)propanenitrile

Systemtic Name: 2-(3-bromanyl-4-pyrazol-1-yl-phenyl)propanenitrile Openeye Name: 2-(3-bromo-4-pyrazol-1-yl-phenyl)propanenitrile CAS Name: 2-[3-bromo-4-(1-pyrazolyl)phenyl]propanenitrile IUPAC Name: 2-(3-bromo-4-pyrazol-1-ylphenyl)propanenitrile Traditional Name: 2-(3-bromo-4-pyrazol-1-yl-phenyl)propionitrile Formula: C12H10BrN3 MolecularWeight: 276.1319

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)C1=CC(=C(C=C1)N2C=CC=N2)Br

Isomeric SMILES

CC(C#N)C1=CC(=C(C=C1)N2C=CC=N2)Br

InChI

InChI=1S/C12H10BrN3/c1-9(8-14)10-3-4-12(11(13)7-10)16-6-2-5-15-16/h2-7,9H,1H3