3-[3-tert-butyl-5-chloranyl-4-(chloromethyl)pyrazol-1-yl]benzenecarbonitrile

Systemtic Name: 3-[3-tert-butyl-5-chloranyl-4-(chloromethyl)pyrazol-1-yl]benzenecarbonitrile Openeye Name: 3-[3-tert-butyl-5-chloro-4-(chloromethyl)pyrazol-1-yl]benzonitrile CAS Name: 3-[3-tert-butyl-5-chloro-4-(chloromethyl)-1-pyrazolyl]benzonitrile IUPAC Name: 3-[3-tert-butyl-5-chloro-4-(chloromethyl)pyrazol-1-yl]benzonitrile Traditional Name: 3-[3-tert-butyl-5-chloro-4-(chloromethyl)pyrazol-1-yl]benzonitrile Formula: C15H15Cl2N3 MolecularWeight: 308.2057

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1CCl)Cl)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1CCl)Cl)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C15H15Cl2N3/c1-15(2,3)13-12(8-16)14(17)20(19-13)11-6-4-5-10(7-11)9-18/h4-7H,8H2,1-3H3