[4-methoxy-2-[2-(4-methoxy-3-oxidanyl-phenyl)ethynyl]-5-propoxy-phenyl] 2-iodanylethanoate; praseodymium

Systemtic Name: [4-methoxy-2-[2-(4-methoxy-3-oxidanyl-phenyl)ethynyl]-5-propoxy-phenyl] 2-iodanylethanoate; praseodymium Openeye Name: [2-[2-(3-hydroxy-4-methoxy-phenyl)ethynyl]-4-methoxy-5-propoxy-phenyl] 2-iodoacetate; praseodymium CAS Name: 2-iodoacetic acid [2-[2-(3-hydroxy-4-methoxyphenyl)ethynyl]-4-methoxy-5-propoxyphenyl] ester; praseodymium IUPAC Name: [2-[2-(3-hydroxy-4-methoxyphenyl)ethynyl]-4-methoxy-5-propoxyphenyl] 2-iodoacetate; praseodymium Traditional Name: 2-iodoacetic acid [2-[2-(3-hydroxy-4-methoxy-phenyl)ethynyl]-4-methoxy-5-propoxy-phenyl] ester; praseodymium Formula: C21H21IO6Pr MolecularWeight: 637.19996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C(=C1)OC(=O)CI)C#CC2=CC(=C(C=C2)OC)O)OC.[Pr]

Isomeric SMILES

CCCOC1=C(C=C(C(=C1)OC(=O)CI)C#CC2=CC(=C(C=C2)OC)O)OC.[Pr]

InChI

InChI=1S/C21H21IO6.Pr/c1-4-9-27-20-12-18(28-21(24)13-22)15(11-19(20)26-3)7-5-14-6-8-17(25-2)16(23)10-14;/h6,8,10-12,23H,4,9,13H2,1-3H3;