2-(3,4-dimethoxyphenyl)ethyl-[[5-(2-fluorophenyl)furan-2-yl]methyl]azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[[5-(2-fluorophenyl)furan-2-yl]methyl]azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[[5-(2-fluorophenyl)-2-furyl]methyl]ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[[5-(2-fluorophenyl)-2-furanyl]methyl]ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[[5-(2-fluorophenyl)furan-2-yl]methyl]azanium Traditional Name: [5-(2-fluorophenyl)-2-furyl]methyl-homoveratryl-ammonium Formula: C21H23FNO3+ MolecularWeight: 356.410623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC[NH2+]CC2=CC=C(O2)C3=CC=CC=C3F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC[NH2+]CC2=CC=C(O2)C3=CC=CC=C3F)OC

InChI

InChI=1S/C21H22FNO3/c1-24-20-9-7-15(13-21(20)25-2)11-12-23-14-16-8-10-19(26-16)17-5-3-4-6-18(17)22/h3-10,13,23H,11-12,14H2,1-2H3/p+1