(6-bromanyl-2-oxidanyl-naphthalen-1-yl)methyl-ethyl-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (6-bromanyl-2-oxidanyl-naphthalen-1-yl)methyl-ethyl-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]azanium Openeye Name: (6-bromo-2-hydroxy-1-naphthyl)methyl-ethyl-[2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl]ammonium CAS Name: (6-bromo-2-hydroxy-1-naphthalenyl)methyl-ethyl-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]ammonium IUPAC Name: (6-bromo-2-hydroxynaphthalen-1-yl)methyl-ethyl-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]azanium Traditional Name: (6-bromo-2-hydroxy-1-naphthyl)methyl-ethyl-[2-[(4-fluorobenzyl)amino]-2-keto-ethyl]ammonium Formula: C22H23BrFN2O2+ MolecularWeight: 446.332623

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=C(C=CC2=C1C=CC(=C2)Br)O)CC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CC[NH+](CC1=C(C=CC2=C1C=CC(=C2)Br)O)CC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C22H22BrFN2O2/c1-2-26(14-22(28)25-12-15-3-7-18(24)8-4-15)13-20-19-9-6-17(23)11-16(19)5-10-21(20)27/h3-11,27H,2,12-14H2,1H3,(H,25,28)/p+1