1H-indole-6-carboxamide; 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: 1H-indole-6-carboxamide; 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: 1H-indole-6-carboxamide citrate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylate; 1H-indole-6-carboxamide IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylate; 1H-indole-6-carboxamide Traditional Name: 1H-indole-6-carboxamide citrate Formula: C15H13N2O8-3 MolecularWeight: 349.27232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C1C=CN2)C(=O)N.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

C1=CC(=CC2=C1C=CN2)C(=O)N.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C9H8N2O.C6H8O7/c10-9(12)7-2-1-6-3-4-11-8(6)5-7;7-3(8)1-6(13,5(11)12)2-4(9)10/h1-5,11H,(H2,10,12);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/p-3