1-adamantyl-[[2,4-bis(fluoranyl)phenyl]methyl]azanium

Systemtic Name: 1-adamantyl-[[2,4-bis(fluoranyl)phenyl]methyl]azanium Openeye Name: 1-adamantyl-[(2,4-difluorophenyl)methyl]ammonium CAS Name: 1-adamantyl-[(2,4-difluorophenyl)methyl]ammonium IUPAC Name: 1-adamantyl-[(2,4-difluorophenyl)methyl]azanium Traditional Name: 1-adamantyl-(2,4-difluorobenzyl)ammonium Formula: C17H22F2N+ MolecularWeight: 278.360086

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=C(C=C(C=C4)F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=C(C=C(C=C4)F)F

InChI

InChI=1S/C17H21F2N/c18-15-2-1-14(16(19)6-15)10-20-17-7-11-3-12(8-17)5-13(4-11)9-17/h1-2,6,11-13,20H,3-5,7-10H2/p+1