2-ethyl-5-oxo-9-piperazin-1-yl-2,8,10-triazabicyclo[4.4.0]deca-3,6,8,10-tetraene-4-carboxylic acid; lanthanum(+3) cation; trichloride
Molecular Formula:
C56H68Cl3LaN20O12
InChI: InChI=1/4C14H17N5O3.3ClH.La/c4*1-2-18-8-10(13(21)22)11(20)9-7-16-14(17-12(9)18)19-5-3-15-4-6-19;;;;/h4*7-8,15H,2-6H2,1H3,(H,21,22);3*1H;/q;;;;;;;+3/p-3/f4C14H17N5O3.3Cl.La/h4*21H;3*1h;/q;;;;3*-1;m
InChIKey: InChIKey=NNUFSPUTGDTIDF-ZIJFAWMCCZ
SMILES: CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCNCC3)C(=O)O.CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCNCC3)C(=O)O.CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCNCC3)C(=O)O.CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCNCC3)C(=O)O.[Cl-].[Cl-].[Cl-].[La+3]
Names:
2-ethyl-5-oxo-9-piperazin-1-yl-2,8,10-triazabicyclo[4.4.0]deca-3,6,8,10-tetraene-4-carboxylic acid; lanthanum(+3) cation; trichloride
Registries:
PubChem CID 10374310
PubChem ID 15387943
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