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

Systemtic Name: [(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]-phenethyl-azanium Openeye Name: [(1S)-1-methyl-2-oxo-2-(propylamino)ethyl]-phenethyl-ammonium CAS Name: [(2S)-1-oxo-1-(propylamino)propan-2-yl]-phenethylammonium IUPAC Name: [(2S)-1-oxo-1-(propylamino)propan-2-yl]-phenethylazanium Traditional Name: [(1S)-2-keto-1-methyl-2-(propylamino)ethyl]-phenethyl-ammonium Formula: C14H23N2O+ MolecularWeight: 235.34522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O/c1-3-10-16-14(17)12(2)15-11-9-13-7-5-4-6-8-13/h4-8,12,15H,3,9-11H2,1-2H3,(H,16,17)/p+1/t12-/m0/s1