5-[4-(2-butoxyethoxy)phenyl]-2-pyrazol-1-yl-benzenecarbonitrile

Systemtic Name: 5-[4-(2-butoxyethoxy)phenyl]-2-pyrazol-1-yl-benzenecarbonitrile Openeye Name: 5-[4-(2-butoxyethoxy)phenyl]-2-pyrazol-1-yl-benzonitrile CAS Name: 5-[4-(2-butoxyethoxy)phenyl]-2-(1-pyrazolyl)benzonitrile IUPAC Name: 5-[4-(2-butoxyethoxy)phenyl]-2-pyrazol-1-ylbenzonitrile Traditional Name: 5-[4-(2-butoxyethoxy)phenyl]-2-pyrazol-1-yl-benzonitrile Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCOC1=CC=C(C=C1)C2=CC(=C(C=C2)N3C=CC=N3)C#N

Isomeric SMILES

CCCCOCCOC1=CC=C(C=C1)C2=CC(=C(C=C2)N3C=CC=N3)C#N

InChI

InChI=1S/C22H23N3O2/c1-2-3-13-26-14-15-27-21-8-5-18(6-9-21)19-7-10-22(20(16-19)17-23)25-12-4-11-24-25/h4-12,16H,2-3,13-15H2,1H3