[(2R)-1-[2-cyanoethyl(methyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium

Systemtic Name: [(2R)-1-[2-cyanoethyl(methyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium Openeye Name: [(1R)-1-benzyl-2-[2-cyanoethyl(methyl)amino]-2-oxo-ethyl]ammonium CAS Name: [(2R)-1-[2-cyanoethyl(methyl)amino]-1-oxo-3-phenylpropan-2-yl]ammonium IUPAC Name: [(2R)-1-[2-cyanoethyl(methyl)amino]-1-oxo-3-phenylpropan-2-yl]azanium Traditional Name: [(1R)-1-benzyl-2-[2-cyanoethyl(methyl)amino]-2-keto-ethyl]ammonium Formula: C13H18N3O+ MolecularWeight: 232.30152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O/c1-16(9-5-8-14)13(17)12(15)10-11-6-3-2-4-7-11/h2-4,6-7,12H,5,9-10,15H2,1H3/p+1/t12-/m1/s1