[(1S)-2-(2-azaniumylethanoylamino)-1-phenyl-ethyl]-diethyl-azanium

Systemtic Name: [(1S)-2-(2-azaniumylethanoylamino)-1-phenyl-ethyl]-diethyl-azanium Openeye Name: [(1S)-2-[(2-azaniumylacetyl)amino]-1-phenyl-ethyl]-diethyl-ammonium CAS Name: [(1S)-2-[(2-ammonio-1-oxoethyl)amino]-1-phenylethyl]-diethylammonium IUPAC Name: [(1S)-2-[(2-azaniumylacetyl)amino]-1-phenylethyl]-diethylazanium Traditional Name: [(1S)-2-[(2-ammonioacetyl)amino]-1-phenyl-ethyl]-diethyl-ammonium Formula: C14H25N3O+2 MolecularWeight: 251.3678

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=O)C[NH3+])C1=CC=CC=C1

Isomeric SMILES

CC[NH+](CC)[C@H](CNC(=O)C[NH3+])C1=CC=CC=C1

InChI

InChI=1S/C14H23N3O/c1-3-17(4-2)13(11-16-14(18)10-15)12-8-6-5-7-9-12/h5-9,13H,3-4,10-11,15H2,1-2H3,(H,16,18)/p+2/t13-/m1/s1