[(2S,3S)-3-methyl-1-oxidanylidene-1-[(phenylmethyl)amino]pentan-2-yl]azanium

Systemtic Name: [(2S,3S)-3-methyl-1-oxidanylidene-1-[(phenylmethyl)amino]pentan-2-yl]azanium Openeye Name: [(1S,2S)-1-(benzylcarbamoyl)-2-methyl-butyl]ammonium CAS Name: [(2S,3S)-3-methyl-1-oxo-1-[(phenylmethyl)amino]pentan-2-yl]ammonium IUPAC Name: [(2S,3S)-1-(benzylamino)-3-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S,2S)-1-(benzylcarbamoyl)-2-methyl-butyl]ammonium Formula: C13H21N2O+ MolecularWeight: 221.31864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O/c1-3-10(2)12(14)13(16)15-9-11-7-5-4-6-8-11/h4-8,10,12H,3,9,14H2,1-2H3,(H,15,16)/p+1/t10-,12-/m0/s1