[(2S)-6-azaniumyl-1-oxidanylidene-1-[[(2S)-1-phenylpropan-2-yl]amino]hexan-2-yl]azanium

Systemtic Name: [(2S)-6-azaniumyl-1-oxidanylidene-1-[[(2S)-1-phenylpropan-2-yl]amino]hexan-2-yl]azanium Openeye Name: [(5S)-5-azaniumyl-6-[[(1S)-1-methyl-2-phenyl-ethyl]amino]-6-oxo-hexyl]ammonium CAS Name: [(2S)-6-ammonio-1-oxo-1-[[(2S)-1-phenylpropan-2-yl]amino]hexan-2-yl]ammonium IUPAC Name: [(2S)-6-azaniumyl-1-oxo-1-[[(2S)-1-phenylpropan-2-yl]amino]hexan-2-yl]azanium Traditional Name: [(5S)-5-ammonio-6-keto-6-[[(1S)-1-methyl-2-phenyl-ethyl]amino]hexyl]ammonium Formula: C15H27N3O+2 MolecularWeight: 265.39438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25N3O/c1-12(11-13-7-3-2-4-8-13)18-15(19)14(17)9-5-6-10-16/h2-4,7-8,12,14H,5-6,9-11,16-17H2,1H3,(H,18,19)/p+2/t12-,14-/m0/s1