2-oxidanylpropane-1,2,3-tricarboxylate; pyridin-1-ium

Systemtic Name: 2-oxidanylpropane-1,2,3-tricarboxylate; pyridin-1-ium Openeye Name: pyridin-1-ium citrate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylate; pyridin-1-ium IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylate; pyridin-1-ium Traditional Name: pyridin-1-ium citrate Formula: C11H11NO7-2 MolecularWeight: 269.20754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[NH+]C=C1.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

C1=CC=[NH+]C=C1.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C6H8O7.C5H5N/c7-3(8)1-6(13,5(11)12)2-4(9)10;1-2-4-6-5-3-1/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);1-5H/p-2