N3-(1-adamantyl)-5-(trifluoromethyl)pyridine-2,3-diamine

Systemtic Name: N3-(1-adamantyl)-5-(trifluoromethyl)pyridine-2,3-diamine Openeye Name: N3-(1-adamantyl)-5-(trifluoromethyl)pyridine-2,3-diamine CAS Name: N3-(1-adamantyl)-5-(trifluoromethyl)pyridine-2,3-diamine IUPAC Name: 3-N-(1-adamantyl)-5-(trifluoromethyl)pyridine-2,3-diamine Traditional Name: 1-adamantyl-[2-amino-5-(trifluoromethyl)-3-pyridyl]amine Formula: C16H20F3N3 MolecularWeight: 311.34531

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC4=C(N=CC(=C4)C(F)(F)F)N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC4=C(N=CC(=C4)C(F)(F)F)N

InChI

InChI=1S/C16H20F3N3/c17-16(18,19)12-4-13(14(20)21-8-12)22-15-5-9-1-10(6-15)3-11(2-9)7-15/h4,8-11,22H,1-3,5-7H2,(H2,20,21)