[5-(4-fluorophenyl)furan-2-yl]methyl-[(2S)-5-methylhexan-2-yl]azanium

Systemtic Name: [5-(4-fluorophenyl)furan-2-yl]methyl-[(2S)-5-methylhexan-2-yl]azanium Openeye Name: [(1S)-1,4-dimethylpentyl]-[[5-(4-fluorophenyl)-2-furyl]methyl]ammonium CAS Name: [5-(4-fluorophenyl)-2-furanyl]methyl-[(2S)-5-methylhexan-2-yl]ammonium IUPAC Name: [5-(4-fluorophenyl)furan-2-yl]methyl-[(2S)-5-methylhexan-2-yl]azanium Traditional Name: [(1S)-1,4-dimethylpentyl]-[[5-(4-fluorophenyl)-2-furyl]methyl]ammonium Formula: C18H25FNO+ MolecularWeight: 290.395603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)[NH2+]CC1=CC=C(O1)C2=CC=C(C=C2)F

Isomeric SMILES

C[C@@H](CCC(C)C)[NH2+]CC1=CC=C(O1)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H24FNO/c1-13(2)4-5-14(3)20-12-17-10-11-18(21-17)15-6-8-16(19)9-7-15/h6-11,13-14,20H,4-5,12H2,1-3H3/p+1/t14-/m0/s1