(11E)-11-[3-[(4R)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]propylidene]-5H-[1]benzoxepino[3,4-b]pyridine-9-carboxylic acid;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxy-2-methylpropoxy)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-4-ol;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3,3-dimethylpiperidin-4-ol;ethyl 2-[[4-(4-chlorophenyl)-4-hydroxy-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-3-yl]methoxy]acetate

C130H148Cl4N8O17 — CID 160881595

IUPAC(11E)-11-[3-[(4R)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]propylidene]-5H-[1]benzoxepino[3,4-b]pyridine-9-carboxylic acid;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxy-2-methylpropoxy)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-4-ol;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3,3-dimethylpiperidin-4-ol;ethyl 2-[[4-(4-chlorophenyl)-4-hydroxy-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-3-yl]methoxy]acetate
SMILESCC(C)(O)c1ccc2c(c1)/C(=C/CCN1CCC(O)(c3ccc(Cl)cc3)C(C)(C)C1)c1cccnc1CO2.CC1(C)CN(CC/C=C2/c3cc(C(=O)O)ccc3OCc3ncccc32)CC[C@@]1(O)c1ccc(Cl)cc1.CC1CN(CC/C=C2/c3cc(OCC(C)(C)O)ccc3OCc3ncccc32)CCC1(O)c1ccc(Cl)cc1.CCOC(=O)COCC1(C)CN(CC/C=C2/c3cc(C(C)(C)O)ccc3OCc3ncccc32)CCC1(O)c1ccc(Cl)cc1
InChIInChI=1S/C36H43ClN2O6.C32H37ClN2O4.C32H37ClN2O3.C30H31ClN2O4/c1-5-44-33(40)22-43-24-35(4)23-39(19-16-36(35,42)25-10-13-27(37)14-11-25)18-7-9-28-29-8-6-17-38-31(29)21-45-32-15-12-26(20-30(28)32)34(2,3)41;1-22-19-35(17-14-32(22,37)23-8-10-24(33)11-9-23)16-5-7-26-27-6-4-15-34-29(27)20-38-30-13-12-25(18-28(26)30)39-21-31(2,3)36;1-30(2)21-35(18-15-32(30,37)22-9-12-24(33)13-10-22)17-6-8-25-26-7-5-16-34-28(26)20-38-29-14-11-23(19-27(25)29)31(3,4)36;1-29(2)19-33(16-13-30(29,36)21-8-10-22(31)11-9-21)15-4-6-23-24-5-3-14-32-26(24)18-37-27-12-7-20(28(34)35)17-25(23)27/h6,8-15,17,20,41-42H,5,7,16,18-19,21-24H2,1-4H3;4,6-13,15,18,22,36-37H,5,14,16-17,19-21H2,1-3H3;5,7-14,16,19,36-37H,6,15,17-18,20-21H2,1-4H3;3,5-12,14,17,36H,4,13,15-16,18-19H2,1-2H3,(H,34,35)/b28-9+;26-7+;25-8+;23-6+/t;;;30-/m...1/s1
InChIKeySNCGWYQGJBYANX-GCXFCCKJSA-N
MW2236.46 g/mol
LogP23.75
Rot. Bonds27

About (11E)-11-[3-[(4R)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]propylidene]-5H-[1]benzoxepino[3,4-b]pyridine-9-carboxylic acid;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxy-2-methylpropoxy)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-4-ol;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3,3-dimethylpiperidin-4-ol;ethyl 2-[[4-(4-chlorophenyl)-4-hydroxy-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-3-yl]methoxy]acetate

(11E)-11-[3-[(4R)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]propylidene]-5H-[1]benzoxepino[3,4-b]pyridine-9-carboxylic acid;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxy-2-methylpropoxy)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-4-ol;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3,3-dimethylpiperidin-4-ol;ethyl 2-[[4-(4-chlorophenyl)-4-hydroxy-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-3-yl]methoxy]acetate (PubChem CID 160881595) has the molecular formula C130H148Cl4N8O17 and a molecular weight of 2236.46 g/mol. Its IUPAC name is (11E)-11-[3-[(4R)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]propylidene]-5H-[1]benzoxepino[3,4-b]pyridine-9-carboxylic acid;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxy-2-methylpropoxy)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-4-ol;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3,3-dimethylpiperidin-4-ol;ethyl 2-[[4-(4-chlorophenyl)-4-hydroxy-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-3-yl]methoxy]acetate.

Molecular Properties

Compound Name(11E)-11-[3-[(4R)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]propylidene]-5H-[1]benzoxepino[3,4-b]pyridine-9-carboxylic acid;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxy-2-methylpropoxy)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-4-ol;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3,3-dimethylpiperidin-4-ol;ethyl 2-[[4-(4-chlorophenyl)-4-hydroxy-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-3-yl]methoxy]acetate
PubChem CID160881595
Molecular FormulaC130H148Cl4N8O17
Molecular Weight2236.46 g/mol
Exact Mass2232.97
IUPAC Name(11E)-11-[3-[(4R)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]propylidene]-5H-[1]benzoxepino[3,4-b]pyridine-9-carboxylic acid;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxy-2-methylpropoxy)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-4-ol;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3,3-dimethylpiperidin-4-ol;ethyl 2-[[4-(4-chlorophenyl)-4-hydroxy-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-3-yl]methoxy]acetate
SMILESCC(C)(O)c1ccc2c(c1)/C(=C/CCN1CCC(O)(c3ccc(Cl)cc3)C(C)(C)C1)c1cccnc1CO2.CC1(C)CN(CC/C=C2/c3cc(C(=O)O)ccc3OCc3ncccc32)CC[C@@]1(O)c1ccc(Cl)cc1.CC1CN(CC/C=C2/c3cc(OCC(C)(C)O)ccc3OCc3ncccc32)CCC1(O)c1ccc(Cl)cc1.CCOC(=O)COCC1(C)CN(CC/C=C2/c3cc(C(C)(C)O)ccc3OCc3ncccc32)CCC1(O)c1ccc(Cl)cc1
InChIInChI=1S/C36H43ClN2O6.C32H37ClN2O4.C32H37ClN2O3.C30H31ClN2O4/c1-5-44-33(40)22-43-24-35(4)23-39(19-16-36(35,42)25-10-13-27(37)14-11-25)18-7-9-28-29-8-6-17-38-31(29)21-45-32-15-12-26(20-30(28)32)34(2,3)41;1-22-19-35(17-14-32(22,37)23-8-10-24(33)11-9-23)16-5-7-26-27-6-4-15-34-29(27)20-38-30-13-12-25(18-28(26)30)39-21-31(2,3)36;1-30(2)21-35(18-15-32(30,37)22-9-12-24(33)13-10-22)17-6-8-25-26-7-5-16-34-28(26)20-38-29-14-11-23(19-27(25)29)31(3,4)36;1-29(2)19-33(16-13-30(29,36)21-8-10-22(31)11-9-21)15-4-6-23-24-5-3-14-32-26(24)18-37-27-12-7-20(28(34)35)17-25(23)27/h6,8-15,17,20,41-42H,5,7,16,18-19,21-24H2,1-4H3;4,6-13,15,18,22,36-37H,5,14,16-17,19-21H2,1-3H3;5,7-14,16,19,36-37H,6,15,17-18,20-21H2,1-4H3;3,5-12,14,17,36H,4,13,15-16,18-19H2,1-2H3,(H,34,35)/b28-9+;26-7+;25-8+;23-6+/t;;;30-/m...1/s1
InChIKeySNCGWYQGJBYANX-GCXFCCKJSA-N
XLogP23.75
TPSA325.11 Ų
H-Bond Donors8
H-Bond Acceptors24
Rotatable Bonds27
Heavy Atoms159
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002236.46
LogP ≤ 523.75
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1024

Analyze (11E)-11-[3-[(4R)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]propylidene]-5H-[1]benzoxepino[3,4-b]pyridine-9-carboxylic acid;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxy-2-methylpropoxy)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-4-ol;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3,3-dimethylpiperidin-4-ol;ethyl 2-[[4-(4-chlorophenyl)-4-hydroxy-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-3-yl]methoxy]acetate with MolForge

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Frequently Asked Questions

What is the IUPAC name of (11E)-11-[3-[(4R)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]propylidene]-5H-[1]benzoxepino[3,4-b]pyridine-9-carboxylic acid;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxy-2-methylpropoxy)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-4-ol;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3,3-dimethylpiperidin-4-ol;ethyl 2-[[4-(4-chlorophenyl)-4-hydroxy-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-3-yl]methoxy]acetate?
The IUPAC name of (11E)-11-[3-[(4R)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]propylidene]-5H-[1]benzoxepino[3,4-b]pyridine-9-carboxylic acid;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxy-2-methylpropoxy)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-4-ol;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3,3-dimethylpiperidin-4-ol;ethyl 2-[[4-(4-chlorophenyl)-4-hydroxy-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-3-yl]methoxy]acetate (CID 160881595) is (11E)-11-[3-[(4R)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]propylidene]-5H-[1]benzoxepino[3,4-b]pyridine-9-carboxylic acid;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxy-2-methylpropoxy)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-4-ol;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3,3-dimethylpiperidin-4-ol;ethyl 2-[[4-(4-chlorophenyl)-4-hydroxy-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-3-yl]methoxy]acetate.
What is the SMILES notation for (11E)-11-[3-[(4R)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]propylidene]-5H-[1]benzoxepino[3,4-b]pyridine-9-carboxylic acid;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxy-2-methylpropoxy)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-4-ol;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3,3-dimethylpiperidin-4-ol;ethyl 2-[[4-(4-chlorophenyl)-4-hydroxy-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-3-yl]methoxy]acetate?
The canonical SMILES for (11E)-11-[3-[(4R)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]propylidene]-5H-[1]benzoxepino[3,4-b]pyridine-9-carboxylic acid;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxy-2-methylpropoxy)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-4-ol;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3,3-dimethylpiperidin-4-ol;ethyl 2-[[4-(4-chlorophenyl)-4-hydroxy-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-3-yl]methoxy]acetate is CC(C)(O)c1ccc2c(c1)/C(=C/CCN1CCC(O)(c3ccc(Cl)cc3)C(C)(C)C1)c1cccnc1CO2.CC1(C)CN(CC/C=C2/c3cc(C(=O)O)ccc3OCc3ncccc32)CC[C@@]1(O)c1ccc(Cl)cc1.CC1CN(CC/C=C2/c3cc(OCC(C)(C)O)ccc3OCc3ncccc32)CCC1(O)c1ccc(Cl)cc1.CCOC(=O)COCC1(C)CN(CC/C=C2/c3cc(C(C)(C)O)ccc3OCc3ncccc32)CCC1(O)c1ccc(Cl)cc1.
What is the InChIKey of (11E)-11-[3-[(4R)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]propylidene]-5H-[1]benzoxepino[3,4-b]pyridine-9-carboxylic acid;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxy-2-methylpropoxy)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-4-ol;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3,3-dimethylpiperidin-4-ol;ethyl 2-[[4-(4-chlorophenyl)-4-hydroxy-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-3-yl]methoxy]acetate?
The InChIKey is SNCGWYQGJBYANX-GCXFCCKJSA-N. The full InChI is InChI=1S/C36H43ClN2O6.C32H37ClN2O4.C32H37ClN2O3.C30H31ClN2O4/c1-5-44-33(40)22-43-24-35(4)23-39(19-16-36(35,42)25-10-13-27(37)14-11-25)18-7-9-28-29-8-6-17-38-31(29)21-45-32-15-12-26(20-30(28)32)34(2,3)41;1-22-19-35(17-14-32(22,37)23-8-10-24(33)11-9-23)16-5-7-26-27-6-4-15-34-29(27)20-38-30-13-12-25(18-28(26)30)39-21-31(2,3)36;1-30(2)21-35(18-15-32(30,37)22-9-12-24(33)13-10-22)17-6-8-25-26-7-5-16-34-28(26)20-38-29-14-11-23(19-27(25)29)31(3,4)36;1-29(2)19-33(16-13-30(29,36)21-8-10-22(31)11-9-21)15-4-6-23-24-5-3-14-32-26(24)18-37-27-12-7-20(28(34)35)17-25(23)27/h6,8-15,17,20,41-42H,5,7,16,18-19,21-24H2,1-4H3;4,6-13,15,18,22,36-37H,5,14,16-17,19-21H2,1-3H3;5,7-14,16,19,36-37H,6,15,17-18,20-21H2,1-4H3;3,5-12,14,17,36H,4,13,15-16,18-19H2,1-2H3,(H,34,35)/b28-9+;26-7+;25-8+;23-6+/t;;;30-/m...1/s1.
What are the key properties of (11E)-11-[3-[(4R)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]propylidene]-5H-[1]benzoxepino[3,4-b]pyridine-9-carboxylic acid;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxy-2-methylpropoxy)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-4-ol;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3,3-dimethylpiperidin-4-ol;ethyl 2-[[4-(4-chlorophenyl)-4-hydroxy-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-3-yl]methoxy]acetate?
(11E)-11-[3-[(4R)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]propylidene]-5H-[1]benzoxepino[3,4-b]pyridine-9-carboxylic acid;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxy-2-methylpropoxy)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-4-ol;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3,3-dimethylpiperidin-4-ol;ethyl 2-[[4-(4-chlorophenyl)-4-hydroxy-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-3-yl]methoxy]acetate has a molecular weight of 2236.46 g/mol, XLogP of 23.75, 27 rotatable bonds, 8 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for (11E)-11-[3-[(4R)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]propylidene]-5H-[1]benzoxepino[3,4-b]pyridine-9-carboxylic acid;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxy-2-methylpropoxy)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-4-ol;4-(4-chlorophenyl)-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3,3-dimethylpiperidin-4-ol;ethyl 2-[[4-(4-chlorophenyl)-4-hydroxy-1-[(3E)-3-[9-(2-hydroxypropan-2-yl)-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene]propyl]-3-methylpiperidin-3-yl]methoxy]acetate is sourced from PubChem (CID 160881595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).