(2S)-2-azaniumyl-6-[[(2R)-3-methyl-3,4-dihydro-2H-pyrrol-2-yl]carbonylamino]hexanoate

Systemtic Name: (2S)-2-azaniumyl-6-[[(2R)-3-methyl-3,4-dihydro-2H-pyrrol-2-yl]carbonylamino]hexanoate Openeye Name: (2S)-2-azaniumyl-6-[[(2R)-3-methyl-3,4-dihydro-2H-pyrrole-2-carbonyl]amino]hexanoate CAS Name: (2S)-2-ammonio-6-[[[(2R)-3-methyl-3,4-dihydro-2H-pyrrol-2-yl]-oxomethyl]amino]hexanoate IUPAC Name: (2S)-2-azaniumyl-6-[[(2R)-3-methyl-3,4-dihydro-2H-pyrrole-2-carbonyl]amino]hexanoate Traditional Name: (2S)-2-ammonio-6-[[(2R)-3-methyl-1-pyrroline-2-carbonyl]amino]hexanoate Formula: C12H21N3O3 MolecularWeight: 255.31344

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC=NC1C(=O)NCCCCC(C(=O)[O-])[NH3+]

Isomeric SMILES

CC1CC=N[C@H]1C(=O)NCCCC[C@@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C12H21N3O3/c1-8-5-7-14-10(8)11(16)15-6-3-2-4-9(13)12(17)18/h7-10H,2-6,13H2,1H3,(H,15,16)(H,17,18)/t8?,9-,10+/m0/s1