(2-oxidanylidene-2-phenylazanyl-ethyl)-[(2S)-pentan-2-yl]azanium

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl)-[(2S)-pentan-2-yl]azanium Openeye Name: (2-anilino-2-oxo-ethyl)-[(1S)-1-methylbutyl]ammonium CAS Name: (2-anilino-2-oxoethyl)-[(2S)-pentan-2-yl]ammonium IUPAC Name: (2-anilino-2-oxoethyl)-[(2S)-pentan-2-yl]azanium Traditional Name: (2-anilino-2-keto-ethyl)-[(1S)-1-methylbutyl]ammonium Formula: C13H21N2O+ MolecularWeight: 221.31864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)[NH2+]CC(=O)NC1=CC=CC=C1

Isomeric SMILES

CCC[C@H](C)[NH2+]CC(=O)NC1=CC=CC=C1

InChI

InChI=1S/C13H20N2O/c1-3-7-11(2)14-10-13(16)15-12-8-5-4-6-9-12/h4-6,8-9,11,14H,3,7,10H2,1-2H3,(H,15,16)/p+1/t11-/m0/s1