1-[2-[(3,4-dimethoxyphenyl)methyl]benzimidazol-1-yl]-3-(4-iodanylphenoxy)propan-2-ol

Systemtic Name: 1-[2-[(3,4-dimethoxyphenyl)methyl]benzimidazol-1-yl]-3-(4-iodanylphenoxy)propan-2-ol Openeye Name: 1-[2-[(3,4-dimethoxyphenyl)methyl]benzimidazol-1-yl]-3-(4-iodophenoxy)propan-2-ol CAS Name: 1-[2-[(3,4-dimethoxyphenyl)methyl]-1-benzimidazolyl]-3-(4-iodophenoxy)-2-propanol IUPAC Name: 1-[2-[(3,4-dimethoxyphenyl)methyl]benzimidazol-1-yl]-3-(4-iodophenoxy)propan-2-ol Traditional Name: 1-(4-iodophenoxy)-3-(2-veratrylbenzimidazol-1-yl)propan-2-ol Formula: C25H25IN2O4 MolecularWeight: 544.38147

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=NC3=CC=CC=C3N2CC(COC4=CC=C(C=C4)I)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=NC3=CC=CC=C3N2CC(COC4=CC=C(C=C4)I)O)OC

InChI

InChI=1S/C25H25IN2O4/c1-30-23-12-7-17(13-24(23)31-2)14-25-27-21-5-3-4-6-22(21)28(25)15-19(29)16-32-20-10-8-18(26)9-11-20/h3-13,19,29H,14-16H2,1-2H3