[azanyl-[4-[[(2S)-2-ethylhexoxy]methyl]-3-fluoranyl-phenyl]methylidene]azanium

Systemtic Name: [azanyl-[4-[[(2S)-2-ethylhexoxy]methyl]-3-fluoranyl-phenyl]methylidene]azanium Openeye Name: [amino-[4-[[(2S)-2-ethylhexoxy]methyl]-3-fluoro-phenyl]methylene]ammonium CAS Name: [amino-[4-[[(2S)-2-ethylhexoxy]methyl]-3-fluorophenyl]methylidene]ammonium IUPAC Name: [amino-[4-[[(2S)-2-ethylhexoxy]methyl]-3-fluorophenyl]methylidene]azanium Traditional Name: [amino-[4-[[(2S)-2-ethylhexoxy]methyl]-3-fluoro-phenyl]methylene]ammonium Formula: C16H26FN2O+ MolecularWeight: 281.388843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COCC1=C(C=C(C=C1)C(=[NH2+])N)F

Isomeric SMILES

CCCC[C@H](CC)COCC1=C(C=C(C=C1)C(=[NH2+])N)F

InChI

InChI=1S/C16H25FN2O/c1-3-5-6-12(4-2)10-20-11-14-8-7-13(16(18)19)9-15(14)17/h7-9,12H,3-6,10-11H2,1-2H3,(H3,18,19)/p+1/t12-/m0/s1