1-tert-butyl-6-methoxy-3-[4-(trifluoromethyl)pyrazol-1-yl]isoquinoline

Systemtic Name: 1-tert-butyl-6-methoxy-3-[4-(trifluoromethyl)pyrazol-1-yl]isoquinoline Openeye Name: 1-tert-butyl-6-methoxy-3-[4-(trifluoromethyl)pyrazol-1-yl]isoquinoline CAS Name: 1-tert-butyl-6-methoxy-3-[4-(trifluoromethyl)-1-pyrazolyl]isoquinoline IUPAC Name: 1-tert-butyl-6-methoxy-3-[4-(trifluoromethyl)pyrazol-1-yl]isoquinoline Traditional Name: 1-tert-butyl-6-methoxy-3-[4-(trifluoromethyl)pyrazol-1-yl]isoquinoline Formula: C18H18F3N3O MolecularWeight: 349.35023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C2C=CC(=CC2=CC(=N1)N3C=C(C=N3)C(F)(F)F)OC

Isomeric SMILES

CC(C)(C)C1=C2C=CC(=CC2=CC(=N1)N3C=C(C=N3)C(F)(F)F)OC

InChI

InChI=1S/C18H18F3N3O/c1-17(2,3)16-14-6-5-13(25-4)7-11(14)8-15(23-16)24-10-12(9-22-24)18(19,20)21/h5-10H,1-4H3