actinium; 2,7-bis(oxidanyl)octan-4-yl bicyclo[2.2.1]hept-2-ene-5-carboxylate

Systemtic Name: actinium; 2,7-bis(oxidanyl)octan-4-yl bicyclo[2.2.1]hept-2-ene-5-carboxylate Openeye Name: actinium; [4-hydroxy-1-(2-hydroxypropyl)pentyl] bicyclo[2.2.1]hept-2-ene-5-carboxylate CAS Name: actinium; 5-bicyclo[2.2.1]hept-2-enecarboxylic acid 2,7-dihydroxyoctan-4-yl ester IUPAC Name: actinium; 2,7-dihydroxyoctan-4-yl bicyclo[2.2.1]hept-2-ene-5-carboxylate Traditional Name: actinium; bicyclo[2.2.1]hept-2-ene-5-carboxylic acid [4-hydroxy-1-(2-hydroxypropyl)pentyl] ester Formula: C16H26AcO4 MolecularWeight: 509.402987

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(CC(C)O)OC(=O)C1CC2CC1C=C2)O.[Ac]

Isomeric SMILES

CC(CCC(CC(C)O)OC(=O)C1CC2CC1C=C2)O.[Ac]

InChI

InChI=1S/C16H26O4.Ac/c1-10(17)3-6-14(7-11(2)18)20-16(19)15-9-12-4-5-13(15)8-12;/h4-5,10-15,17-18H,3,6-9H2,1-2H3;