[3-fluoranyl-4-[(1S,3S)-3-methylcyclohexyl]oxy-phenyl]methylazanium

Systemtic Name: [3-fluoranyl-4-[(1S,3S)-3-methylcyclohexyl]oxy-phenyl]methylazanium Openeye Name: [3-fluoro-4-[(1S,3S)-3-methylcyclohexoxy]phenyl]methylammonium CAS Name: [3-fluoro-4-[(1S,3S)-3-methylcyclohexyl]oxyphenyl]methylammonium IUPAC Name: [3-fluoro-4-[(1S,3S)-3-methylcyclohexyl]oxyphenyl]methylazanium Traditional Name: [3-fluoro-4-[(1S,3S)-3-methylcyclohexoxy]benzyl]ammonium Formula: C14H21FNO+ MolecularWeight: 238.321043

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)OC2=C(C=C(C=C2)C[NH3+])F

Isomeric SMILES

C[C@H]1CCC[C@@H](C1)OC2=C(C=C(C=C2)C[NH3+])F

InChI

InChI=1S/C14H20FNO/c1-10-3-2-4-12(7-10)17-14-6-5-11(9-16)8-13(14)15/h5-6,8,10,12H,2-4,7,9,16H2,1H3/p+1/t10-,12-/m0/s1