2H-1,2-benzodiazepine-3-carboxamide; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: 2H-1,2-benzodiazepine-3-carboxamide; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: 2H-1,2-benzodiazepine-3-carboxamide; citric acid CAS Name: 2H-1,2-benzodiazepine-3-carboxamide; 2-hydroxypropane-1,2,3-tricarboxylic acid IUPAC Name: 2H-1,2-benzodiazepine-3-carboxamide; 2-hydroxypropane-1,2,3-tricarboxylic acid Traditional Name: 2H-1,2-benzodiazepine-3-carboxamide; citric acid Formula: C16H17N3O8 MolecularWeight: 379.32148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC=C(NN=C2C=C1)C(=O)N.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

C1=CC2=CC=C(NN=C2C=C1)C(=O)N.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C10H9N3O.C6H8O7/c11-10(14)9-6-5-7-3-1-2-4-8(7)12-13-9;7-3(8)1-6(13,5(11)12)2-4(9)10/h1-6,13H,(H2,11,14);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)