2-[5-(4-bromophenyl)sulfonylbenzotriazol-2-yl]-6-tert-butyl-phenol

Systemtic Name: 2-[5-(4-bromophenyl)sulfonylbenzotriazol-2-yl]-6-tert-butyl-phenol Openeye Name: 2-[5-(4-bromophenyl)sulfonylbenzotriazol-2-yl]-6-tert-butyl-phenol CAS Name: 2-[5-(4-bromophenyl)sulfonyl-2-benzotriazolyl]-6-tert-butylphenol IUPAC Name: 2-[5-(4-bromophenyl)sulfonylbenzotriazol-2-yl]-6-tert-butylphenol Traditional Name: 2-(5-brosylbenzotriazol-2-yl)-6-tert-butyl-phenol Formula: C22H20BrN3O3S MolecularWeight: 486.3815

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=CC=C1)N2N=C3C=CC(=CC3=N2)S(=O)(=O)C4=CC=C(C=C4)Br)O

Isomeric SMILES

CC(C)(C)C1=C(C(=CC=C1)N2N=C3C=CC(=CC3=N2)S(=O)(=O)C4=CC=C(C=C4)Br)O

InChI

InChI=1S/C22H20BrN3O3S/c1-22(2,3)17-5-4-6-20(21(17)27)26-24-18-12-11-16(13-19(18)25-26)30(28,29)15-9-7-14(23)8-10-15/h4-13,27H,1-3H3