2,6-bis(azanyl)-4-(3-azidophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 2,6-bis(azanyl)-4-(3-azidophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 2,6-diamino-4-(3-azidophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 2,6-diamino-4-(3-azidophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 2,6-diamino-4-(3-azidophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 2,6-diamino-4-(3-azidophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C13H12N6O4 MolecularWeight: 316.27218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N=[N+]=[N-])C2C(=C(NC(=C2C(=O)O)N)N)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N=[N+]=[N-])C2C(=C(NC(=C2C(=O)O)N)N)C(=O)O

InChI

InChI=1S/C13H12N6O4/c14-10-8(12(20)21)7(9(13(22)23)11(15)17-10)5-2-1-3-6(4-5)18-19-16/h1-4,7,17H,14-15H2,(H,20,21)(H,22,23)