3,5-ditert-butyl-1-(3-chloranyl-4-methyl-phenyl)pyrazole

Systemtic Name: 3,5-ditert-butyl-1-(3-chloranyl-4-methyl-phenyl)pyrazole Openeye Name: 3,5-ditert-butyl-1-(3-chloro-4-methyl-phenyl)pyrazole CAS Name: 3,5-ditert-butyl-1-(3-chloro-4-methylphenyl)pyrazole IUPAC Name: 3,5-ditert-butyl-1-(3-chloro-4-methylphenyl)pyrazole Traditional Name: 3,5-ditert-butyl-1-(3-chloro-4-methyl-phenyl)pyrazole Formula: C18H25ClN2 MolecularWeight: 304.8575

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=CC(=N2)C(C)(C)C)C(C)(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=CC(=N2)C(C)(C)C)C(C)(C)C)Cl

InChI

InChI=1S/C18H25ClN2/c1-12-8-9-13(10-14(12)19)21-16(18(5,6)7)11-15(20-21)17(2,3)4/h8-11H,1-7H3