2-(1-adamantyl)-1,2,3-triazole-4,5-dicarboxylic acid

Systemtic Name: 2-(1-adamantyl)-1,2,3-triazole-4,5-dicarboxylic acid Openeye Name: 2-(1-adamantyl)triazole-4,5-dicarboxylic acid CAS Name: 2-(1-adamantyl)triazole-4,5-dicarboxylic acid IUPAC Name: 2-(1-adamantyl)triazole-4,5-dicarboxylic acid Traditional Name: 2-(1-adamantyl)triazole-4,5-dicarboxylic acid Formula: C14H17N3O4 MolecularWeight: 291.30248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N4N=C(C(=N4)C(=O)O)C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N4N=C(C(=N4)C(=O)O)C(=O)O

InChI

InChI=1S/C14H17N3O4/c18-12(19)10-11(13(20)21)16-17(15-10)14-4-7-1-8(5-14)3-9(2-7)6-14/h7-9H,1-6H2,(H,18,19)(H,20,21)