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calcium (2S)-2-(aminocarbonylamino)butanedioate

calcium (2S)-2-(aminocarbonylamino)butanedioate

Systemtic Name:calcium (2S)-2-(aminocarbonylamino)butanedioate
Openeye Name:calcium (2S)-2-ureidobutanedioate
CAS Name:calcium (2S)-2-(carbamoylamino)butanedioate
IUPAC Name:calcium (2S)-2-(carbamoylamino)butanedioate
Traditional Name:calcium (2S)-2-ureidosuccinate
Formula: C5H6CaN2O5
MolecularWeight: 214.18954
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Descriptors Computed from Structure

Canonical SMILES:

C(C(C(=O)[O-])NC(=O)N)C(=O)[O-].[Ca+2]


Isomeric SMILES

C([C@@H](C(=O)[O-])NC(=O)N)C(=O)[O-].[Ca+2]


InChI

InChI=1S/C5H8N2O5.Ca/c6-5(12)7-2(4(10)11)1-3(8)9;/h2H,1H2,(H,8,9)(H,10,11)(H3,6,7,12);/q;+2/p-2/t2-;/m0./s1


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