2-[1-[4-(3-bromophenyl)phenyl]-5-chloranyl-pyrazol-4-yl]ethanenitrile

Systemtic Name: 2-[1-[4-(3-bromophenyl)phenyl]-5-chloranyl-pyrazol-4-yl]ethanenitrile Openeye Name: 2-[1-[4-(3-bromophenyl)phenyl]-5-chloro-pyrazol-4-yl]acetonitrile CAS Name: 2-[1-[4-(3-bromophenyl)phenyl]-5-chloro-4-pyrazolyl]acetonitrile IUPAC Name: 2-[1-[4-(3-bromophenyl)phenyl]-5-chloropyrazol-4-yl]acetonitrile Traditional Name: 2-[1-[4-(3-bromophenyl)phenyl]-5-chloro-pyrazol-4-yl]acetonitrile Formula: C17H11BrClN3 MolecularWeight: 372.64634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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