1-(1-adamantyl)-1-[4-fluoranyl-2-(trifluoromethyl)phenyl]guanidine

Systemtic Name: 1-(1-adamantyl)-1-[4-fluoranyl-2-(trifluoromethyl)phenyl]guanidine Openeye Name: 1-(1-adamantyl)-1-[4-fluoro-2-(trifluoromethyl)phenyl]guanidine CAS Name: 1-(1-adamantyl)-1-[4-fluoro-2-(trifluoromethyl)phenyl]guanidine IUPAC Name: 1-(1-adamantyl)-1-[4-fluoro-2-(trifluoromethyl)phenyl]guanidine Traditional Name: 1-(1-adamantyl)-1-[4-fluoro-2-(trifluoromethyl)phenyl]guanidine Formula: C18H21F4N3 MolecularWeight: 355.373053

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21F4N3/c19-13-1-2-15(14(6-13)18(20,21)22)25(16(23)24)17-7-10-3-11(8-17)5-12(4-10)9-17/h1-2,6,10-12H,3-5,7-9H2,(H3,23,24)