[3-fluoranyl-4-[(2-propan-2-ylphenoxy)methyl]phenyl]methylazanium

Systemtic Name: [3-fluoranyl-4-[(2-propan-2-ylphenoxy)methyl]phenyl]methylazanium Openeye Name: [3-fluoro-4-[(2-isopropylphenoxy)methyl]phenyl]methylammonium CAS Name: [3-fluoro-4-[(2-propan-2-ylphenoxy)methyl]phenyl]methylammonium IUPAC Name: [3-fluoro-4-[(2-propan-2-ylphenoxy)methyl]phenyl]methylazanium Traditional Name: [3-fluoro-4-[(2-isopropylphenoxy)methyl]benzyl]ammonium Formula: C17H21FNO+ MolecularWeight: 274.353143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OCC2=C(C=C(C=C2)C[NH3+])F

Isomeric SMILES

CC(C)C1=CC=CC=C1OCC2=C(C=C(C=C2)C[NH3+])F

InChI

InChI=1S/C17H20FNO/c1-12(2)15-5-3-4-6-17(15)20-11-14-8-7-13(10-19)9-16(14)18/h3-9,12H,10-11,19H2,1-2H3/p+1