[4-fluoranyl-3-(2-methylpropoxymethyl)phenyl]methylazanium

Systemtic Name: [4-fluoranyl-3-(2-methylpropoxymethyl)phenyl]methylazanium Openeye Name: [4-fluoro-3-(isobutoxymethyl)phenyl]methylammonium CAS Name: [4-fluoro-3-(2-methylpropoxymethyl)phenyl]methylammonium IUPAC Name: [4-fluoro-3-(2-methylpropoxymethyl)phenyl]methylazanium Traditional Name: [4-fluoro-3-(isobutoxymethyl)benzyl]ammonium Formula: C12H19FNO+ MolecularWeight: 212.283763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCC1=C(C=CC(=C1)C[NH3+])F

Isomeric SMILES

CC(C)COCC1=C(C=CC(=C1)C[NH3+])F

InChI

InChI=1S/C12H18FNO/c1-9(2)7-15-8-11-5-10(6-14)3-4-12(11)13/h3-5,9H,6-8,14H2,1-2H3/p+1