[(2S)-1-oxidanylidene-1-(prop-2-ynylamino)propan-2-yl]-phenethyl-azanium

Systemtic Name: [(2S)-1-oxidanylidene-1-(prop-2-ynylamino)propan-2-yl]-phenethyl-azanium Openeye Name: [(1S)-1-methyl-2-oxo-2-(prop-2-ynylamino)ethyl]-phenethyl-ammonium CAS Name: [(2S)-1-oxo-1-(prop-2-ynylamino)propan-2-yl]-phenethylammonium IUPAC Name: [(2S)-1-oxo-1-(prop-2-ynylamino)propan-2-yl]-phenethylazanium Traditional Name: [(1S)-2-keto-1-methyl-2-(propargylamino)ethyl]-phenethyl-ammonium Formula: C14H19N2O+ MolecularWeight: 231.31346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC#C)[NH2+]CCC1=CC=CC=C1

Isomeric SMILES

C[C@@H](C(=O)NCC#C)[NH2+]CCC1=CC=CC=C1

InChI

InChI=1S/C14H18N2O/c1-3-10-16-14(17)12(2)15-11-9-13-7-5-4-6-8-13/h1,4-8,12,15H,9-11H2,2H3,(H,16,17)/p+1/t12-/m0/s1