[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(1R)-1-naphthalen-1-ylethyl]azanium

Systemtic Name: [2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(1R)-1-naphthalen-1-ylethyl]azanium Openeye Name: [2-(4-bromo-2-fluoro-anilino)-2-oxo-ethyl]-[(1R)-1-(1-naphthyl)ethyl]ammonium CAS Name: [2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-[(1R)-1-(1-naphthalenyl)ethyl]ammonium IUPAC Name: [2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-[(1R)-1-naphthalen-1-ylethyl]azanium Traditional Name: [2-(4-bromo-2-fluoro-anilino)-2-keto-ethyl]-[(1R)-1-(1-naphthyl)ethyl]ammonium Formula: C20H19BrFN2O+ MolecularWeight: 402.280063

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)[NH2+]CC(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C[C@H](C1=CC=CC2=CC=CC=C21)[NH2+]CC(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C20H18BrFN2O/c1-13(16-8-4-6-14-5-2-3-7-17(14)16)23-12-20(25)24-19-10-9-15(21)11-18(19)22/h2-11,13,23H,12H2,1H3,(H,24,25)/p+1/t13-/m1/s1