tetraoxidanium; [3-(aminomethyl)cyclohexyl]methanediol; [3,5-bis(aminomethyl)cyclohexyl]methanediol; erbium; ethane-1,1-diol; methanediol; methanol

Systemtic Name: tetraoxidanium; [3-(aminomethyl)cyclohexyl]methanediol; [3,5-bis(aminomethyl)cyclohexyl]methanediol; erbium; ethane-1,1-diol; methanediol; methanol Openeye Name: tetraoxonium; [3-(aminomethyl)cyclohexyl]methanediol; [3,5-bis(aminomethyl)cyclohexyl]methanediol; erbium; ethane-1,1-diol; methanediol; methanol CAS Name: tetraoxonium; [3-(aminomethyl)cyclohexyl]methanediol; [3,5-bis(aminomethyl)cyclohexyl]methanediol; erbium; ethane-1,1-diol; methanediol; methanol IUPAC Name: tetraoxidanium; [3-(aminomethyl)cyclohexyl]methanediol; [3,5-bis(aminomethyl)cyclohexyl]methanediol; erbium; ethane-1,1-diol; methanediol; methanol Traditional Name: tetraoxonium; [3-(aminomethyl)cyclohexyl]methanediol; [3,5-bis(aminomethyl)cyclohexyl]methanediol; erbium; ethane-1,1-diol; methanediol; methanol Formula: C26H79Er2N3O18+4 MolecularWeight: 1056.43276

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Descriptors Computed from Structure

Canonical SMILES:

CC(O)O.CC(O)O.CC(O)O.CO.CO.C1CC(CC(C1)C(O)O)CN.C1C(CC(CC1CN)C(O)O)CN.C(O)O.[OH3+].[OH3+].[OH3+].[OH3+].[Er].[Er]

Isomeric SMILES

CC(O)O.CC(O)O.CC(O)O.CO.CO.C1CC(CC(C1)C(O)O)CN.C1C(CC(CC1CN)C(O)O)CN.C(O)O.[OH3+].[OH3+].[OH3+].[OH3+].[Er].[Er]

InChI

InChI=1S/C9H20N2O2.C8H17NO2.3C2H6O2.CH4O2.2CH4O.2Er.4H2O/c10-4-6-1-7(5-11)3-8(2-6)9(12)13;9-5-6-2-1-3-7(4-6)8(10)11;3*1-2(3)4;2-1-3;2*1-2;;;;;;/h6-9,12-13H,1-5,10-11H2;6-8,10-11H,1-5,9H2;3*2-4H,1H3;2-3H,1H2;2*2H,1H3;;;4*1H2/p+4