[3-fluoranyl-4-(4-methylpentoxy)phenyl]methylazanium

Systemtic Name: [3-fluoranyl-4-(4-methylpentoxy)phenyl]methylazanium Openeye Name: (3-fluoro-4-isohexyloxy-phenyl)methylammonium CAS Name: [3-fluoro-4-(4-methylpentoxy)phenyl]methylammonium IUPAC Name: [3-fluoro-4-(4-methylpentoxy)phenyl]methylazanium Traditional Name: (3-fluoro-4-isohexyloxy-benzyl)ammonium Formula: C13H21FNO+ MolecularWeight: 226.310343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC1=C(C=C(C=C1)C[NH3+])F

Isomeric SMILES

CC(C)CCCOC1=C(C=C(C=C1)C[NH3+])F

InChI

InChI=1S/C13H20FNO/c1-10(2)4-3-7-16-13-6-5-11(9-15)8-12(13)14/h5-6,8,10H,3-4,7,9,15H2,1-2H3/p+1