ethyl 2-[2-(benzotriazol-2-yl)-4-bromanyl-phenoxy]-2-(4-tert-butylphenyl)ethanoate

Systemtic Name: ethyl 2-[2-(benzotriazol-2-yl)-4-bromanyl-phenoxy]-2-(4-tert-butylphenyl)ethanoate Openeye Name: ethyl 2-[2-(benzotriazol-2-yl)-4-bromo-phenoxy]-2-(4-tert-butylphenyl)acetate CAS Name: 2-[2-(2-benzotriazolyl)-4-bromophenoxy]-2-(4-tert-butylphenyl)acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(benzotriazol-2-yl)-4-bromophenoxy]-2-(4-tert-butylphenyl)acetate Traditional Name: 2-[2-(benzotriazol-2-yl)-4-bromo-phenoxy]-2-(4-tert-butylphenyl)acetic acid ethyl ester Formula: C26H26BrN3O3 MolecularWeight: 508.40694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=C(C=C1)C(C)(C)C)OC2=C(C=C(C=C2)Br)N3N=C4C=CC=CC4=N3

Isomeric SMILES

CCOC(=O)C(C1=CC=C(C=C1)C(C)(C)C)OC2=C(C=C(C=C2)Br)N3N=C4C=CC=CC4=N3

InChI

InChI=1S/C26H26BrN3O3/c1-5-32-25(31)24(17-10-12-18(13-11-17)26(2,3)4)33-23-15-14-19(27)16-22(23)30-28-20-8-6-7-9-21(20)29-30/h6-16,24H,5H2,1-4H3