N-[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]-3-iodanyl-benzamide

Systemtic Name: N-[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]-3-iodanyl-benzamide Openeye Name: N-[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]-3-iodo-benzamide CAS Name: N-[2-(4-ethoxyphenyl)-6-methyl-5-benzotriazolyl]-3-iodobenzamide IUPAC Name: N-[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]-3-iodobenzamide Traditional Name: 3-iodo-N-(6-methyl-2-p-phenetyl-benzotriazol-5-yl)benzamide Formula: C22H19IN4O2 MolecularWeight: 498.31633

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=O)C4=CC(=CC=C4)I)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=O)C4=CC(=CC=C4)I)C

InChI

InChI=1S/C22H19IN4O2/c1-3-29-18-9-7-17(8-10-18)27-25-20-11-14(2)19(13-21(20)26-27)24-22(28)15-5-4-6-16(23)12-15/h4-13H,3H2,1-2H3,(H,24,28)