N-methylbenzamide; 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: N-methylbenzamide; 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: N-methylbenzamide citrate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylate; N-methylbenzamide IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylate; N-methylbenzamide Traditional Name: N-methylbenzamide citrate Formula: C14H14NO8-3 MolecularWeight: 324.26286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=CC=C1.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

CNC(=O)C1=CC=CC=C1.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C8H9NO.C6H8O7/c1-9-8(10)7-5-3-2-4-6-7;7-3(8)1-6(13,5(11)12)2-4(9)10/h2-6H,1H3,(H,9,10);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/p-3