2-[5-bromanyl-1-[4-(3-chlorophenyl)phenyl]pyrazol-4-yl]ethanenitrile

Systemtic Name: 2-[5-bromanyl-1-[4-(3-chlorophenyl)phenyl]pyrazol-4-yl]ethanenitrile Openeye Name: 2-[5-bromo-1-[4-(3-chlorophenyl)phenyl]pyrazol-4-yl]acetonitrile CAS Name: 2-[5-bromo-1-[4-(3-chlorophenyl)phenyl]-4-pyrazolyl]acetonitrile IUPAC Name: 2-[5-bromo-1-[4-(3-chlorophenyl)phenyl]pyrazol-4-yl]acetonitrile Traditional Name: 2-[5-bromo-1-[4-(3-chlorophenyl)phenyl]pyrazol-4-yl]acetonitrile Formula: C17H11BrClN3 MolecularWeight: 372.64634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C2=CC=C(C=C2)N3C(=C(C=N3)CC#N)Br

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C2=CC=C(C=C2)N3C(=C(C=N3)CC#N)Br

InChI

InChI=1S/C17H11BrClN3/c18-17-14(8-9-20)11-21-22(17)16-6-4-12(5-7-16)13-2-1-3-15(19)10-13/h1-7,10-11H,8H2