zinc; benzoic acid; cyclohexanecarboxylic acid; 3,6-dihydro-2H-pyridin-1-id-3-ylmethanol; piperidin-1-id-3-ylmethanol; zinc; dihydrate

Systemtic Name: zinc; benzoic acid; cyclohexanecarboxylic acid; 3,6-dihydro-2H-pyridin-1-id-3-ylmethanol; piperidin-1-id-3-ylmethanol; zinc; dihydrate Openeye Name: zinc; benzoic acid; cyclohexanecarboxylic acid; 3,6-dihydro-2H-pyridin-1-id-3-ylmethanol; piperidin-1-id-3-ylmethanol; zinc; dihydrate CAS Name: zinc; benzoic acid; cyclohexanecarboxylic acid; 3,6-dihydro-2H-pyridin-1-id-3-ylmethanol; 3-piperidin-1-idylmethanol; zinc; dihydrate IUPAC Name: zinc; benzoic acid; cyclohexanecarboxylic acid; 3,6-dihydro-2H-pyridin-1-id-3-ylmethanol; piperidin-1-id-3-ylmethanol; zinc; dihydrate Traditional Name: zinc; benzoic acid; cyclohexanecarboxylic acid; 3,6-dihydro-2H-pyridin-1-id-3-ylmethanol; piperidin-1-id-3-ylmethanol; zinc; dihydrate Formula: C26H44N2O8Zn3 MolecularWeight: 708.86316

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)O.C1CC(C[N-]C1)CO.C1C=CC(C[N-]1)CO.C1=CC=C(C=C1)C(=O)O.O.O.[Zn].[Zn].[Zn+2]

Isomeric SMILES

C1CCC(CC1)C(=O)O.C1CC(C[N-]C1)CO.C1C=CC(C[N-]1)CO.C1=CC=C(C=C1)C(=O)O.O.O.[Zn].[Zn].[Zn+2]

InChI

InChI=1S/C7H12O2.C7H6O2.C6H12NO.C6H10NO.2H2O.3Zn/c2*8-7(9)6-4-2-1-3-5-6;2*8-5-6-2-1-3-7-4-6;;;;;/h6H,1-5H2,(H,8,9);1-5H,(H,8,9);6,8H,1-5H2;1-2,6,8H,3-5H2;2*1H2;;;/q;;2*-1;;;;;+2