2-[2-(benzotriazol-2-yl)-4-methyl-phenoxy]-N-(4-iodanyl-2-methyl-phenyl)ethanamide

Systemtic Name: 2-[2-(benzotriazol-2-yl)-4-methyl-phenoxy]-N-(4-iodanyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[2-(benzotriazol-2-yl)-4-methyl-phenoxy]-N-(4-iodo-2-methyl-phenyl)acetamide CAS Name: 2-[2-(2-benzotriazolyl)-4-methylphenoxy]-N-(4-iodo-2-methylphenyl)acetamide IUPAC Name: 2-[2-(benzotriazol-2-yl)-4-methylphenoxy]-N-(4-iodo-2-methylphenyl)acetamide Traditional Name: 2-[2-(benzotriazol-2-yl)-4-methyl-phenoxy]-N-(4-iodo-2-methyl-phenyl)acetamide Formula: C22H19IN4O2 MolecularWeight: 498.31633

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NC2=C(C=C(C=C2)I)C)N3N=C4C=CC=CC4=N3

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NC2=C(C=C(C=C2)I)C)N3N=C4C=CC=CC4=N3

InChI

InChI=1S/C22H19IN4O2/c1-14-7-10-21(20(11-14)27-25-18-5-3-4-6-19(18)26-27)29-13-22(28)24-17-9-8-16(23)12-15(17)2/h3-12H,13H2,1-2H3,(H,24,28)