cyclohexanamine; 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: cyclohexanamine; 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: cyclohexanamine citrate CAS Name: cyclohexanamine; 2-hydroxypropane-1,2,3-tricarboxylate IUPAC Name: cyclohexanamine; 2-hydroxypropane-1,2,3-tricarboxylate Traditional Name: cyclohexylamine citrate Formula: C12H18NO7-3 MolecularWeight: 288.27382

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

C1CCC(CC1)N.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C6H13N.C6H8O7/c7-6-4-2-1-3-5-6;7-3(8)1-6(13,5(11)12)2-4(9)10/h6H,1-5,7H2;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/p-3