2-[(4S)-2,2-dimethyl-4-phenyl-oxan-4-yl]ethyl-[(2-fluorophenyl)methyl]azanium

Systemtic Name: 2-[(4S)-2,2-dimethyl-4-phenyl-oxan-4-yl]ethyl-[(2-fluorophenyl)methyl]azanium Openeye Name: 2-[(4S)-2,2-dimethyl-4-phenyl-tetrahydropyran-4-yl]ethyl-[(2-fluorophenyl)methyl]ammonium CAS Name: 2-[(4S)-2,2-dimethyl-4-phenyl-4-oxanyl]ethyl-[(2-fluorophenyl)methyl]ammonium IUPAC Name: 2-[(4S)-2,2-dimethyl-4-phenyloxan-4-yl]ethyl-[(2-fluorophenyl)methyl]azanium Traditional Name: 2-[(4S)-2,2-dimethyl-4-phenyl-tetrahydropyran-4-yl]ethyl-(2-fluorobenzyl)ammonium Formula: C22H29FNO+ MolecularWeight: 342.470163

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)(CC[NH2+]CC2=CC=CC=C2F)C3=CC=CC=C3)C

Isomeric SMILES

CC1(C[C@@](CCO1)(CC[NH2+]CC2=CC=CC=C2F)C3=CC=CC=C3)C

InChI

InChI=1S/C22H28FNO/c1-21(2)17-22(13-15-25-21,19-9-4-3-5-10-19)12-14-24-16-18-8-6-7-11-20(18)23/h3-11,24H,12-17H2,1-2H3/p+1/t22-/m0/s1