[2-[2-(3-methoxy-4-propan-2-yloxy-phenyl)ethynyl]-5-(propan-2-yloxymethoxy)phenyl] 2-iodanylethanoate

Systemtic Name: [2-[2-(3-methoxy-4-propan-2-yloxy-phenyl)ethynyl]-5-(propan-2-yloxymethoxy)phenyl] 2-iodanylethanoate Openeye Name: [5-(isopropoxymethoxy)-2-[2-(4-isopropoxy-3-methoxy-phenyl)ethynyl]phenyl] 2-iodoacetate CAS Name: 2-iodoacetic acid [2-[2-(3-methoxy-4-propan-2-yloxyphenyl)ethynyl]-5-(propan-2-yloxymethoxy)phenyl] ester IUPAC Name: [2-[2-(3-methoxy-4-propan-2-yloxyphenyl)ethynyl]-5-(propan-2-yloxymethoxy)phenyl] 2-iodoacetate Traditional Name: 2-iodoacetic acid [5-(isopropoxymethoxy)-2-[2-(4-isopropoxy-3-methoxy-phenyl)ethynyl]phenyl] ester Formula: C24H27IO6 MolecularWeight: 538.37205

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCOC1=CC(=C(C=C1)C#CC2=CC(=C(C=C2)OC(C)C)OC)OC(=O)CI

Isomeric SMILES

CC(C)OCOC1=CC(=C(C=C1)C#CC2=CC(=C(C=C2)OC(C)C)OC)OC(=O)CI

InChI

InChI=1S/C24H27IO6/c1-16(2)28-15-29-20-10-9-19(22(13-20)31-24(26)14-25)8-6-18-7-11-21(30-17(3)4)23(12-18)27-5/h7,9-13,16-17H,14-15H2,1-5H3