[(2S)-1-[4-(2-azanyl-2-oxidanylidene-ethyl)piperazin-4-ium-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[4-(2-azanyl-2-oxidanylidene-ethyl)piperazin-4-ium-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium Openeye Name: [(1S)-2-[4-(2-amino-2-oxo-ethyl)piperazin-4-ium-1-yl]-1-benzyl-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[4-(2-amino-2-oxoethyl)-1-piperazin-4-iumyl]-1-oxo-3-phenylpropan-2-yl]ammonium IUPAC Name: [(2S)-1-[4-(2-amino-2-oxoethyl)piperazin-4-ium-1-yl]-1-oxo-3-phenylpropan-2-yl]azanium Traditional Name: [(1S)-2-[4-(2-amino-2-keto-ethyl)piperazin-4-ium-1-yl]-1-benzyl-2-keto-ethyl]ammonium Formula: C15H24N4O2+2 MolecularWeight: 292.37666

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N)C(=O)C(CC2=CC=CC=C2)[NH3+]

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N)C(=O)[C@H](CC2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C15H22N4O2/c16-13(10-12-4-2-1-3-5-12)15(21)19-8-6-18(7-9-19)11-14(17)20/h1-5,13H,6-11,16H2,(H2,17,20)/p+2/t13-/m0/s1