(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylic acid;5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid

C138H138N6O54 — CID 159552835

About (6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylic acid;5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid

(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylic acid;5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid (PubChem CID 159552835) has the molecular formula C138H138N6O54 and a molecular weight of 2744.61 g/mol. Its IUPAC name is (6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylic acid;5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid.

Molecular Properties

• Compound Name: (6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylic acid;5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid
• PubChem CID: 159552835
• Molecular Formula: C138H138N6O54
• Molecular Weight: 2744.61 g/mol
• Exact Mass: 2742.82
• IUPAC Name: (6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylic acid;5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid
• SMILES: C=C(C)C(=O)OC1C2CC3C(=O)OC1(OC=O)C3C2.C=C(C)C(=O)OC1C2CC3C1OC(=O)C3(C#N)C2.C=C(C)C(=O)OC1C2CC3C1OC(=O)C3C2C#N.C=C(C)C(=O)OC1C2CC3C1OC(=O)C3C2C(=O)O.C=C(C)C(=O)OC1C2OC(=O)C3CC1(C(=O)O)CC32.C=CC(=O)OC1C2CC3C(=O)OC1(OC=O)C3C2.C=CC(=O)OC1C2CC3C1OC(=O)C3(C#N)C2.C=CC(=O)OC1C2CC3C1OC(=O)C3C2C#N.C=CC(=O)OC1C2OC(=O)C3CC1(C(=O)O)CC32.[C-]#[N+]C12OC(=O)C3CC(CC31)C2OC(=O)C(=C)C.[C-]#[N+]C12OC(=O)C3CC(CC31)C2OC(=O)C=C
• InChI: InChI=1S/3C13H13NO4.3C13H14O6.3C12H11NO4.2C12H12O6/c1-6(2)11(15)17-10-7-4-8-9(5-7)13(10,14-3)18-12(8)16;1-6(2)11(15)17-9-7-3-8-10(9)18-12(16)13(8,4-7)5-14;1-5(2)12(15)17-10-6-3-7-9(8(6)4-14)13(16)18-11(7)10;1-6(2)11(15)18-10-7-3-8-9(4-7)13(10,17-5-14)19-12(8)16;1-5(2)10(14)19-9-8-6-3-13(9,12(16)17)4-7(6)11(15)18-8;1-4(2)12(16)18-9-5-3-6-8(7(5)11(14)15)13(17)19-10(6)9;1-3-9(14)16-10-6-4-7-8(5-6)12(10,13-2)17-11(7)15;1-2-8(14)16-9-6-3-7-10(9)17-11(15)12(7,4-6)5-13;1-2-8(14)16-10-5-3-6-9(7(5)4-13)12(15)17-11(6)10;1-2-9(14)17-10-6-3-7-8(4-6)12(10,16-5-13)18-11(7)15;1-2-7(13)17-9-8-5-3-12(9,11(15)16)4-6(5)10(14)18-8/h7-10H,1,4-5H2,2H3;7-10H,1,3-4H2,2H3;6-11H,1,3H2,2H3;5,7-10H,1,3-4H2,2H3;6-9H,1,3-4H2,2H3,(H,16,17);5-10H,1,3H2,2H3,(H,14,15);3,6-8,10H,1,4-5H2;2,6-7,9-10H,1,3-4H2;2,5-7,9-11H,1,3H2;2,5-8,10H,1,3-4H2;2,5-6,8-9H,1,3-4H2,(H,15,16)
• InChIKey: MFPOPKCVEUFEBA-UHFFFAOYSA-N
• XLogP: 6.66
• TPSA: 846.98 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 55
• Rotatable Bonds: 29
• Heavy Atoms: 198
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2744.61
LogP ≤ 5	6.66
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	55

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylic acid;5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid?

The IUPAC name of (6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylic acid;5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid (CID 159552835) is (6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylic acid;5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid.

What is the SMILES notation for (6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylic acid;5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid?

The canonical SMILES for (6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylic acid;5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid is C=C(C)C(=O)OC1C2CC3C(=O)OC1(OC=O)C3C2.C=C(C)C(=O)OC1C2CC3C1OC(=O)C3(C#N)C2.C=C(C)C(=O)OC1C2CC3C1OC(=O)C3C2C#N.C=C(C)C(=O)OC1C2CC3C1OC(=O)C3C2C(=O)O.C=C(C)C(=O)OC1C2OC(=O)C3CC1(C(=O)O)CC32.C=CC(=O)OC1C2CC3C(=O)OC1(OC=O)C3C2.C=CC(=O)OC1C2CC3C1OC(=O)C3(C#N)C2.C=CC(=O)OC1C2CC3C1OC(=O)C3C2C#N.C=CC(=O)OC1C2OC(=O)C3CC1(C(=O)O)CC32.[C-]#[N+]C12OC(=O)C3CC(CC31)C2OC(=O)C(=C)C.[C-]#[N+]C12OC(=O)C3CC(CC31)C2OC(=O)C=C.

What is the InChIKey of (6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylic acid;5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid?

The InChIKey is MFPOPKCVEUFEBA-UHFFFAOYSA-N. The full InChI is InChI=1S/3C13H13NO4.3C13H14O6.3C12H11NO4.2C12H12O6/c1-6(2)11(15)17-10-7-4-8-9(5-7)13(10,14-3)18-12(8)16;1-6(2)11(15)17-9-7-3-8-10(9)18-12(16)13(8,4-7)5-14;1-5(2)12(15)17-10-6-3-7-9(8(6)4-14)13(16)18-11(7)10;1-6(2)11(15)18-10-7-3-8-9(4-7)13(10,17-5-14)19-12(8)16;1-5(2)10(14)19-9-8-6-3-13(9,12(16)17)4-7(6)11(15)18-8;1-4(2)12(16)18-9-5-3-6-8(7(5)11(14)15)13(17)19-10(6)9;1-3-9(14)16-10-6-4-7-8(5-6)12(10,13-2)17-11(7)15;1-2-8(14)16-9-6-3-7-10(9)17-11(15)12(7,4-6)5-13;1-2-8(14)16-10-5-3-6-9(7(5)4-13)12(15)17-11(6)10;1-2-9(14)17-10-6-3-7-8(4-6)12(10,16-5-13)18-11(7)15;1-2-7(13)17-9-8-5-3-12(9,11(15)16)4-6(5)10(14)18-8/h7-10H,1,4-5H2,2H3;7-10H,1,3-4H2,2H3;6-11H,1,3H2,2H3;5,7-10H,1,3-4H2,2H3;6-9H,1,3-4H2,2H3,(H,16,17);5-10H,1,3H2,2H3,(H,14,15);3,6-8,10H,1,4-5H2;2,6-7,9-10H,1,3-4H2;2,5-7,9-11H,1,3H2;2,5-8,10H,1,3-4H2;2,5-6,8-9H,1,3-4H2,(H,15,16).

What are the key properties of (6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylic acid;5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid?

(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylic acid;5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid has a molecular weight of 2744.61 g/mol, XLogP of 6.66, 29 rotatable bonds, 3 hydrogen bond donors, and 55 hydrogen bond acceptors.

Where does this data come from?

All data for (6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(9-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-formyloxy-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2-methylprop-2-enoate;(3-isocyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) prop-2-enoate;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid;2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylic acid;5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-1-carboxylic acid is sourced from PubChem (CID 159552835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).