[(2S)-1-[(4-fluoranyl-3-oxidanylidene-1-phenyl-butan-2-yl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]azanium chloride

Systemtic Name: [(2S)-1-[(4-fluoranyl-3-oxidanylidene-1-phenyl-butan-2-yl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]azanium chloride Openeye Name: [(1S)-1-[(1-benzyl-3-fluoro-2-oxo-propyl)carbamoyl]-3-methyl-butyl]ammonium chloride CAS Name: [(2S)-1-[(4-fluoro-3-oxo-1-phenylbutan-2-yl)amino]-4-methyl-1-oxopentan-2-yl]ammonium chloride IUPAC Name: [(2S)-1-[(4-fluoro-3-oxo-1-phenylbutan-2-yl)amino]-4-methyl-1-oxopentan-2-yl]azanium chloride Traditional Name: [(1S)-1-[(1-benzyl-3-fluoro-2-keto-propyl)carbamoyl]-3-methyl-butyl]ammonium chloride Formula: C16H24ClFN2O2 MolecularWeight: 330.825363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)CF)[NH3+].[Cl-]

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC(CC1=CC=CC=C1)C(=O)CF)[NH3+].[Cl-]

InChI

InChI=1S/C16H23FN2O2.ClH/c1-11(2)8-13(18)16(21)19-14(15(20)10-17)9-12-6-4-3-5-7-12;/h3-7,11,13-14H,8-10,18H2,1-2H3,(H,19,21);1H/t13-,14?;/m0./s1