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

Systemtic Name: [2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(1R)-2-methyl-1-phenyl-propyl]azanium Openeye Name: [2-(4-bromo-2-fluoro-anilino)-2-oxo-ethyl]-[(1R)-2-methyl-1-phenyl-propyl]ammonium CAS Name: [2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-[(1R)-2-methyl-1-phenylpropyl]ammonium IUPAC Name: [2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-[(1R)-2-methyl-1-phenylpropyl]azanium Traditional Name: [2-(4-bromo-2-fluoro-anilino)-2-keto-ethyl]-[(1R)-2-methyl-1-phenyl-propyl]ammonium Formula: C18H21BrFN2O+ MolecularWeight: 380.274543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CC=C1)[NH2+]CC(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CC(C)[C@H](C1=CC=CC=C1)[NH2+]CC(=O)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C18H20BrFN2O/c1-12(2)18(13-6-4-3-5-7-13)21-11-17(23)22-16-9-8-14(19)10-15(16)20/h3-10,12,18,21H,11H2,1-2H3,(H,22,23)/p+1/t18-/m1/s1