[(4S)-4-(4-fluoranylphenoxy)-4-(2-methoxy-5-methyl-phenyl)butyl]azanium

Systemtic Name: [(4S)-4-(4-fluoranylphenoxy)-4-(2-methoxy-5-methyl-phenyl)butyl]azanium Openeye Name: [(4S)-4-(4-fluorophenoxy)-4-(2-methoxy-5-methyl-phenyl)butyl]ammonium CAS Name: [(4S)-4-(4-fluorophenoxy)-4-(2-methoxy-5-methylphenyl)butyl]ammonium IUPAC Name: [(4S)-4-(4-fluorophenoxy)-4-(2-methoxy-5-methylphenyl)butyl]azanium Traditional Name: [(4S)-4-(4-fluorophenoxy)-4-(2-methoxy-5-methyl-phenyl)butyl]ammonium Formula: C18H23FNO2+ MolecularWeight: 304.379123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(CCC[NH3+])OC2=CC=C(C=C2)F

Isomeric SMILES

CC1=CC(=C(C=C1)OC)[C@H](CCC[NH3+])OC2=CC=C(C=C2)F

InChI

InChI=1S/C18H22FNO2/c1-13-5-10-17(21-2)16(12-13)18(4-3-11-20)22-15-8-6-14(19)7-9-15/h5-10,12,18H,3-4,11,20H2,1-2H3/p+1/t18-/m0/s1