bis[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-[(2S)-3-methylbutan-2-yl]azanium

Systemtic Name: bis[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-[(2S)-3-methylbutan-2-yl]azanium Openeye Name: [(1S)-1,2-dimethylpropyl]-bis[2-(4-fluoroanilino)-2-oxo-ethyl]ammonium CAS Name: bis[2-(4-fluoroanilino)-2-oxoethyl]-[(2S)-3-methylbutan-2-yl]ammonium IUPAC Name: bis[2-(4-fluoroanilino)-2-oxoethyl]-[(2S)-3-methylbutan-2-yl]azanium Traditional Name: [(1S)-1,2-dimethylpropyl]-bis[2-(4-fluoroanilino)-2-keto-ethyl]ammonium Formula: C21H26F2N3O2+ MolecularWeight: 390.446846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)[NH+](CC(=O)NC1=CC=C(C=C1)F)CC(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

C[C@@H](C(C)C)[NH+](CC(=O)NC1=CC=C(C=C1)F)CC(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C21H25F2N3O2/c1-14(2)15(3)26(12-20(27)24-18-8-4-16(22)5-9-18)13-21(28)25-19-10-6-17(23)7-11-19/h4-11,14-15H,12-13H2,1-3H3,(H,24,27)(H,25,28)/p+1/t15-/m0/s1