[(2S,3S)-1-[(3-fluorophenyl)methylamino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S,3S)-1-[(3-fluorophenyl)methylamino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S,2S)-1-[(3-fluorophenyl)methylcarbamoyl]-2-methyl-butyl]ammonium CAS Name: [(2S,3S)-1-[(3-fluorophenyl)methylamino]-3-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S,3S)-1-[(3-fluorophenyl)methylamino]-3-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S,2S)-1-[(3-fluorobenzyl)carbamoyl]-2-methyl-butyl]ammonium Formula: C13H20FN2O+ MolecularWeight: 239.309103

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCC1=CC(=CC=C1)F)[NH3+]

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NCC1=CC(=CC=C1)F)[NH3+]

InChI

InChI=1S/C13H19FN2O/c1-3-9(2)12(15)13(17)16-8-10-5-4-6-11(14)7-10/h4-7,9,12H,3,8,15H2,1-2H3,(H,16,17)/p+1/t9-,12-/m0/s1