N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-4-(trifluoromethyl)pyrimidin-2-amine

Systemtic Name: N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-4-(trifluoromethyl)pyrimidin-2-amine Openeye Name: N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-4-(trifluoromethyl)pyrimidin-2-amine CAS Name: N-(5-spiro[1,3-benzodioxole-2,1'-cyclohexane]yl)-4-(trifluoromethyl)-2-pyrimidinamine IUPAC Name: N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-4-(trifluoromethyl)pyrimidin-2-amine Traditional Name: spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-[4-(trifluoromethyl)pyrimidin-2-yl]amine Formula: C17H16F3N3O2 MolecularWeight: 351.32305

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC4=NC=CC(=N4)C(F)(F)F

Isomeric SMILES

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC4=NC=CC(=N4)C(F)(F)F

InChI

InChI=1S/C17H16F3N3O2/c18-17(19,20)14-6-9-21-15(23-14)22-11-4-5-12-13(10-11)25-16(24-12)7-2-1-3-8-16/h4-6,9-10H,1-3,7-8H2,(H,21,22,23)