[(2S)-1-oxidanylidene-1-[(phenylmethyl)-propan-2-yl-amino]propan-2-yl]azanium

Systemtic Name: [(2S)-1-oxidanylidene-1-[(phenylmethyl)-propan-2-yl-amino]propan-2-yl]azanium Openeye Name: [(1S)-2-[benzyl(isopropyl)amino]-1-methyl-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-oxo-1-[(phenylmethyl)-propan-2-ylamino]propan-2-yl]ammonium IUPAC Name: [(2S)-1-[benzyl(propan-2-yl)amino]-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-[benzyl(isopropyl)amino]-2-keto-1-methyl-ethyl]ammonium Formula: C13H21N2O+ MolecularWeight: 221.31864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C(=O)C(C)[NH3+]

Isomeric SMILES

C[C@@H](C(=O)N(CC1=CC=CC=C1)C(C)C)[NH3+]

InChI

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