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

Systemtic Name: 2-[(2S,4R)-2-ethyl-2-methyl-4-phenyl-oxan-4-yl]ethyl-[(2-fluorophenyl)methyl]azanium Openeye Name: 2-[(2S,4R)-2-ethyl-2-methyl-4-phenyl-tetrahydropyran-4-yl]ethyl-[(2-fluorophenyl)methyl]ammonium CAS Name: 2-[(2S,4R)-2-ethyl-2-methyl-4-phenyl-4-oxanyl]ethyl-[(2-fluorophenyl)methyl]ammonium IUPAC Name: 2-[(2S,4R)-2-ethyl-2-methyl-4-phenyloxan-4-yl]ethyl-[(2-fluorophenyl)methyl]azanium Traditional Name: 2-[(2S,4R)-2-ethyl-2-methyl-4-phenyl-tetrahydropyran-4-yl]ethyl-(2-fluorobenzyl)ammonium Formula: C23H31FNO+ MolecularWeight: 356.496743

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(CCO1)(CC[NH2+]CC2=CC=CC=C2F)C3=CC=CC=C3)C

Isomeric SMILES

CC[C@]1(C[C@](CCO1)(CC[NH2+]CC2=CC=CC=C2F)C3=CC=CC=C3)C

InChI

InChI=1S/C23H30FNO/c1-3-22(2)18-23(14-16-26-22,20-10-5-4-6-11-20)13-15-25-17-19-9-7-8-12-21(19)24/h4-12,25H,3,13-18H2,1-2H3/p+1/t22-,23+/m0/s1