6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-7H-purin-2-amine

Systemtic Name: 6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-7H-purin-2-amine Openeye Name: 6-[4-[2-(trifluoromethyl)phenoxy]-1-piperidyl]-7H-purin-2-amine CAS Name: 6-[4-[2-(trifluoromethyl)phenoxy]-1-piperidinyl]-7H-purin-2-amine IUPAC Name: 6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-7H-purin-2-amine Traditional Name: [6-[4-[2-(trifluoromethyl)phenoxy]piperidino]-7H-purin-2-yl]amine Formula: C17H17F3N6O MolecularWeight: 378.35169

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC=CC=C2C(F)(F)F)C3=NC(=NC4=C3NC=N4)N

Isomeric SMILES

C1CN(CCC1OC2=CC=CC=C2C(F)(F)F)C3=NC(=NC4=C3NC=N4)N

InChI

InChI=1S/C17H17F3N6O/c18-17(19,20)11-3-1-2-4-12(11)27-10-5-7-26(8-6-10)15-13-14(23-9-22-13)24-16(21)25-15/h1-4,9-10H,5-8H2,(H3,21,22,23,24,25)