2-(triphenylmethyl)-1,2,4-triazole-3-carboxylic acid

Systemtic Name: 2-(triphenylmethyl)-1,2,4-triazole-3-carboxylic acid Openeye Name: 2-trityl-1,2,4-triazole-3-carboxylic acid CAS Name: 2-(triphenylmethyl)-1,2,4-triazole-3-carboxylic acid IUPAC Name: 2-trityl-1,2,4-triazole-3-carboxylic acid Traditional Name: 2-trityl-1,2,4-triazole-3-carboxylic acid Formula: C22H17N3O2 MolecularWeight: 355.38928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C(=NC=N4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C(=NC=N4)C(=O)O

InChI

InChI=1S/C22H17N3O2/c26-21(27)20-23-16-24-25(20)22(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-16H,(H,26,27)