[(2S)-2-(4-fluoranyl-3-methyl-phenyl)-2-(3-propan-2-ylphenoxy)ethyl]azanium

Systemtic Name: [(2S)-2-(4-fluoranyl-3-methyl-phenyl)-2-(3-propan-2-ylphenoxy)ethyl]azanium Openeye Name: [(2S)-2-(4-fluoro-3-methyl-phenyl)-2-(3-isopropylphenoxy)ethyl]ammonium CAS Name: [(2S)-2-(4-fluoro-3-methylphenyl)-2-(3-propan-2-ylphenoxy)ethyl]ammonium IUPAC Name: [(2S)-2-(4-fluoro-3-methylphenyl)-2-(3-propan-2-ylphenoxy)ethyl]azanium Traditional Name: [(2S)-2-(4-fluoro-3-methyl-phenyl)-2-(3-isopropylphenoxy)ethyl]ammonium Formula: C18H23FNO+ MolecularWeight: 288.379723

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22FNO/c1-12(2)14-5-4-6-16(10-14)21-18(11-20)15-7-8-17(19)13(3)9-15/h4-10,12,18H,11,20H2,1-3H3/p+1/t18-/m1/s1