2-(3-methyl-5-octyl-2-oxidanyl-phenyl)benzotriazole-5-carboxylic acid

Systemtic Name: 2-(3-methyl-5-octyl-2-oxidanyl-phenyl)benzotriazole-5-carboxylic acid Openeye Name: 2-(2-hydroxy-3-methyl-5-octyl-phenyl)benzotriazole-5-carboxylic acid CAS Name: 2-(2-hydroxy-3-methyl-5-octylphenyl)-5-benzotriazolecarboxylic acid IUPAC Name: 2-(2-hydroxy-3-methyl-5-octylphenyl)benzotriazole-5-carboxylic acid Traditional Name: 2-(2-hydroxy-3-methyl-5-octyl-phenyl)benzotriazole-5-carboxylic acid Formula: C22H27N3O3 MolecularWeight: 381.46808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=C(C(=C1)N2N=C3C=CC(=CC3=N2)C(=O)O)O)C

Isomeric SMILES

CCCCCCCCC1=CC(=C(C(=C1)N2N=C3C=CC(=CC3=N2)C(=O)O)O)C

InChI

InChI=1S/C22H27N3O3/c1-3-4-5-6-7-8-9-16-12-15(2)21(26)20(13-16)25-23-18-11-10-17(22(27)28)14-19(18)24-25/h10-14,26H,3-9H2,1-2H3,(H,27,28)