actinium; [1-[2-(2-methyl-3-oxidanyl-phenyl)-4,5-dihydro-1,3-oxazol-4-yl]-2-oxidanyl-ethyl] methanesulfonate

Systemtic Name: actinium; [1-[2-(2-methyl-3-oxidanyl-phenyl)-4,5-dihydro-1,3-oxazol-4-yl]-2-oxidanyl-ethyl] methanesulfonate Openeye Name: actinium; [2-hydroxy-1-[2-(3-hydroxy-2-methyl-phenyl)-4,5-dihydrooxazol-4-yl]ethyl] methanesulfonate CAS Name: actinium; methanesulfonic acid [2-hydroxy-1-[2-(3-hydroxy-2-methylphenyl)-4,5-dihydrooxazol-4-yl]ethyl] ester IUPAC Name: actinium; [2-hydroxy-1-[2-(3-hydroxy-2-methylphenyl)-4,5-dihydro-1,3-oxazol-4-yl]ethyl] methanesulfonate Traditional Name: actinium; methanesulfonic acid [2-hydroxy-1-[2-(3-hydroxy-2-methyl-phenyl)-2-oxazolin-4-yl]ethyl] ester Formula: C13H17Ac2NO6S MolecularWeight: 769.397674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1O)C2=NC(CO2)C(CO)OS(=O)(=O)C.[Ac].[Ac]

Isomeric SMILES

CC1=C(C=CC=C1O)C2=NC(CO2)C(CO)OS(=O)(=O)C.[Ac].[Ac]

InChI

InChI=1S/C13H17NO6S.2Ac/c1-8-9(4-3-5-11(8)16)13-14-10(7-19-13)12(6-15)20-21(2,17)18;;/h3-5,10,12,15-16H,6-7H2,1-2H3;;