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

Systemtic Name: 5-chloranyl-1-(triphenylmethyl)-1,2,4-triazole-3-carboxylic acid Openeye Name: 5-chloro-1-trityl-1,2,4-triazole-3-carboxylic acid CAS Name: 5-chloro-1-(triphenylmethyl)-1,2,4-triazole-3-carboxylic acid IUPAC Name: 5-chloro-1-trityl-1,2,4-triazole-3-carboxylic acid Traditional Name: 5-chloro-1-trityl-1,2,4-triazole-3-carboxylic acid Formula: C22H16ClN3O2 MolecularWeight: 389.83434

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C22H16ClN3O2/c23-21-24-19(20(27)28)25-26(21)22(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H,(H,27,28)