(3-bromanyl-5-ethoxy-4-prop-2-enoxy-phenyl)methyl-[(1R)-1-(3-fluorophenyl)ethyl]azanium

Systemtic Name: (3-bromanyl-5-ethoxy-4-prop-2-enoxy-phenyl)methyl-[(1R)-1-(3-fluorophenyl)ethyl]azanium Openeye Name: (4-allyloxy-3-bromo-5-ethoxy-phenyl)methyl-[(1R)-1-(3-fluorophenyl)ethyl]ammonium CAS Name: (3-bromo-5-ethoxy-4-prop-2-enoxyphenyl)methyl-[(1R)-1-(3-fluorophenyl)ethyl]ammonium IUPAC Name: (3-bromo-5-ethoxy-4-prop-2-enoxyphenyl)methyl-[(1R)-1-(3-fluorophenyl)ethyl]azanium Traditional Name: (4-allyloxy-3-bromo-5-ethoxy-benzyl)-[(1R)-1-(3-fluorophenyl)ethyl]ammonium Formula: C20H24BrFNO2+ MolecularWeight: 409.312463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]C(C)C2=CC(=CC=C2)F)Br)OCC=C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+][C@H](C)C2=CC(=CC=C2)F)Br)OCC=C

InChI

InChI=1S/C20H23BrFNO2/c1-4-9-25-20-18(21)10-15(11-19(20)24-5-2)13-23-14(3)16-7-6-8-17(22)12-16/h4,6-8,10-12,14,23H,1,5,9,13H2,2-3H3/p+1/t14-/m1/s1