Bromoethane;2-chloro-7,9-dihydro-6H-pyrido[3,2-b]indolizin-8-one;(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol;6-chloropyridine-3-carbaldehyde;ethyl 3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)propanoate;ethyl (E)-3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl 2-azidoacetate;methyl 6-chloro-1-ethylpyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1-ethylpyrrolo[3,2-c]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate
C122H123BrCl9N20O19P — CID 157159421
Data last refreshed: (MolForge compound catalog, from PubChem)
IUPACbromoethane;2-chloro-7,9-dihydro-6H-pyrido[3,2-b]indolizin-8-one;(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol;6-chloropyridine-3-carbaldehyde;ethyl 3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)propanoate;ethyl (E)-3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl 2-azidoacetate;methyl 6-chloro-1-ethylpyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1-ethylpyrrolo[3,2-c]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate
SMILESCCBr.CCOC(=O)/C=C/c1cc2ccc(Cl)nc2n1CC.CCOC(=O)C=P(c1ccccc1)(c1ccccc1)c1ccccc1.CCOC(=O)CCc1cc2ccc(Cl)nc2n1CC.CCn1c(C(=O)OC)cc2ccc(Cl)nc21.CCn1c(C(=O)OC)cc2cnc(Cl)cc21.CCn1c(CO)cc2ccc(Cl)nc21.COC(=O)CN=[N+]=[N-].COC(=O)c1cc2ccc(Cl)nc2[nH]1.COC(=O)c1cc2cnc(Cl)cc2[nH]1.O=C1CCc2cc3ccc(Cl)nc3n2C1.O=Cc1ccc(Cl)nc1
InChIInChI=1S/C22H21O2P.C14H17ClN2O2.C14H15ClN2O2.2C11H11ClN2O2.C11H9ClN2O.C10H11ClN2O.2C9H7ClN2O2.C6H4ClNO.C3H5N3O2.C2H5Br/c1-2-24-22(23)18-25(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21;2*1-3-17-11(6-8-13(18)19-4-2)9-10-5-7-12(15)16-14(10)17;1-3-14-8-5-10(12)13-6-7(8)4-9(14)11(15)16-2;1-3-14-8(11(15)16-2)6-7-4-5-9(12)13-10(7)14;12-10-4-1-7-5-8-2-3-9(15)6-14(8)11(7)13-10;1-2-13-8(6-14)5-7-3-4-9(11)12-10(7)13;1-14-9(13)7-2-5-4-11-8(10)3-6(5)12-7;1-14-9(13)6-4-5-2-3-7(10)12-8(5)11-6;7-6-2-1-5(4-9)3-8-6;1-8-3(7)2-5-6-4;1-2-3/h3-18H,2H2,1H3;5,7,9H,3-4,6,8H2,1-2H3;5-9H,3-4H2,1-2H3;2*4-6H,3H2,1-2H3;1,4-5H,2-3,6H2;3-5,14H,2,6H2,1H3;2-4,12H,1H3;2-4H,1H3,(H,11,12);1-4H;2H2,1H3;2H2,1H3/b;;8-6+;;;;;;;;;
InChIKeyAMEROLGOELCGHA-LKAWRJFBSA-N
MW2603.40 g/mol
LogP26.66
Rot. Bonds25
About Bromoethane;2-chloro-7,9-dihydro-6H-pyrido[3,2-b]indolizin-8-one;(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol;6-chloropyridine-3-carbaldehyde;ethyl 3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)propanoate;ethyl (E)-3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl 2-azidoacetate;methyl 6-chloro-1-ethylpyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1-ethylpyrrolo[3,2-c]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate
Bromoethane;2-chloro-7,9-dihydro-6H-pyrido[3,2-b]indolizin-8-one;(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol;6-chloropyridine-3-carbaldehyde;ethyl 3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)propanoate;ethyl (E)-3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl 2-azidoacetate;methyl 6-chloro-1-ethylpyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1-ethylpyrrolo[3,2-c]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate (PubChem CID 157159421) has the molecular formula C122H123BrCl9N20O19P and a molecular weight of 2603.40 g/mol. Its IUPAC name is bromoethane;2-chloro-7,9-dihydro-6H-pyrido[3,2-b]indolizin-8-one;(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol;6-chloropyridine-3-carbaldehyde;ethyl 3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)propanoate;ethyl (E)-3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl 2-azidoacetate;methyl 6-chloro-1-ethylpyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1-ethylpyrrolo[3,2-c]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate.
Molecular Properties
| Compound Name | Bromoethane;2-chloro-7,9-dihydro-6H-pyrido[3,2-b]indolizin-8-one;(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol;6-chloropyridine-3-carbaldehyde;ethyl 3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)propanoate;ethyl (E)-3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl 2-azidoacetate;methyl 6-chloro-1-ethylpyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1-ethylpyrrolo[3,2-c]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate |
|---|---|
| PubChem CID | 157159421 |
| Molecular Formula | C122H123BrCl9N20O19P |
| Molecular Weight | 2603.40 g/mol |
| Exact Mass | 2596.54 |
| IUPAC Name | bromoethane;2-chloro-7,9-dihydro-6H-pyrido[3,2-b]indolizin-8-one;(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol;6-chloropyridine-3-carbaldehyde;ethyl 3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)propanoate;ethyl (E)-3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl 2-azidoacetate;methyl 6-chloro-1-ethylpyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1-ethylpyrrolo[3,2-c]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate |
| SMILES | CCBr.CCOC(=O)/C=C/c1cc2ccc(Cl)nc2n1CC.CCOC(=O)C=P(c1ccccc1)(c1ccccc1)c1ccccc1.CCOC(=O)CCc1cc2ccc(Cl)nc2n1CC.CCn1c(C(=O)OC)cc2ccc(Cl)nc21.CCn1c(C(=O)OC)cc2cnc(Cl)cc21.CCn1c(CO)cc2ccc(Cl)nc21.COC(=O)CN=[N+]=[N-].COC(=O)c1cc2ccc(Cl)nc2[nH]1.COC(=O)c1cc2cnc(Cl)cc2[nH]1.O=C1CCc2cc3ccc(Cl)nc3n2C1.O=Cc1ccc(Cl)nc1 |
| InChI | InChI=1S/C22H21O2P.C14H17ClN2O2.C14H15ClN2O2.2C11H11ClN2O2.C11H9ClN2O.C10H11ClN2O.2C9H7ClN2O2.C6H4ClNO.C3H5N3O2.C2H5Br/c1-2-24-22(23)18-25(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21;2*1-3-17-11(6-8-13(18)19-4-2)9-10-5-7-12(15)16-14(10)17;1-3-14-8-5-10(12)13-6-7(8)4-9(14)11(15)16-2;1-3-14-8(11(15)16-2)6-7-4-5-9(12)13-10(7)14;12-10-4-1-7-5-8-2-3-9(15)6-14(8)11(7)13-10;1-2-13-8(6-14)5-7-3-4-9(11)12-10(7)13;1-14-9(13)7-2-5-4-11-8(10)3-6(5)12-7;1-14-9(13)6-4-5-2-3-7(10)12-8(5)11-6;7-6-2-1-5(4-9)3-8-6;1-8-3(7)2-5-6-4;1-2-3/h3-18H,2H2,1H3;5,7,9H,3-4,6,8H2,1-2H3;5-9H,3-4H2,1-2H3;2*4-6H,3H2,1-2H3;1,4-5H,2-3,6H2;3-5,14H,2,6H2,1H3;2-4,12H,1H3;2-4H,1H3,(H,11,12);1-4H;2H2,1H3;2H2,1H3/b;;8-6+;;;;;;;;; |
| InChIKey | AMEROLGOELCGHA-LKAWRJFBSA-N |
| XLogP | 26.66 |
| TPSA | 490.70 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 35 |
| Rotatable Bonds | 25 |
| Heavy Atoms | 172 |
| Complexity | — |
Lipinski Rule of Five
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2603.40 |
| LogP ≤ 5 | 26.66 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 35 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'} |
|---|
Frequently Asked Questions
What is the IUPAC name of Bromoethane;2-chloro-7,9-dihydro-6H-pyrido[3,2-b]indolizin-8-one;(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol;6-chloropyridine-3-carbaldehyde;ethyl 3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)propanoate;ethyl (E)-3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl 2-azidoacetate;methyl 6-chloro-1-ethylpyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1-ethylpyrrolo[3,2-c]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate?
The IUPAC name of Bromoethane;2-chloro-7,9-dihydro-6H-pyrido[3,2-b]indolizin-8-one;(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol;6-chloropyridine-3-carbaldehyde;ethyl 3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)propanoate;ethyl (E)-3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl 2-azidoacetate;methyl 6-chloro-1-ethylpyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1-ethylpyrrolo[3,2-c]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate (CID 157159421) is bromoethane;2-chloro-7,9-dihydro-6H-pyrido[3,2-b]indolizin-8-one;(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol;6-chloropyridine-3-carbaldehyde;ethyl 3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)propanoate;ethyl (E)-3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl 2-azidoacetate;methyl 6-chloro-1-ethylpyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1-ethylpyrrolo[3,2-c]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate.
What is the SMILES notation for Bromoethane;2-chloro-7,9-dihydro-6H-pyrido[3,2-b]indolizin-8-one;(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol;6-chloropyridine-3-carbaldehyde;ethyl 3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)propanoate;ethyl (E)-3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl 2-azidoacetate;methyl 6-chloro-1-ethylpyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1-ethylpyrrolo[3,2-c]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate?
The canonical SMILES for Bromoethane;2-chloro-7,9-dihydro-6H-pyrido[3,2-b]indolizin-8-one;(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol;6-chloropyridine-3-carbaldehyde;ethyl 3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)propanoate;ethyl (E)-3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl 2-azidoacetate;methyl 6-chloro-1-ethylpyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1-ethylpyrrolo[3,2-c]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate is CCBr.CCOC(=O)/C=C/c1cc2ccc(Cl)nc2n1CC.CCOC(=O)C=P(c1ccccc1)(c1ccccc1)c1ccccc1.CCOC(=O)CCc1cc2ccc(Cl)nc2n1CC.CCn1c(C(=O)OC)cc2ccc(Cl)nc21.CCn1c(C(=O)OC)cc2cnc(Cl)cc21.CCn1c(CO)cc2ccc(Cl)nc21.COC(=O)CN=[N+]=[N-].COC(=O)c1cc2ccc(Cl)nc2[nH]1.COC(=O)c1cc2cnc(Cl)cc2[nH]1.O=C1CCc2cc3ccc(Cl)nc3n2C1.O=Cc1ccc(Cl)nc1.
What is the InChIKey of Bromoethane;2-chloro-7,9-dihydro-6H-pyrido[3,2-b]indolizin-8-one;(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol;6-chloropyridine-3-carbaldehyde;ethyl 3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)propanoate;ethyl (E)-3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl 2-azidoacetate;methyl 6-chloro-1-ethylpyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1-ethylpyrrolo[3,2-c]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate?
The InChIKey is AMEROLGOELCGHA-LKAWRJFBSA-N. The full InChI is InChI=1S/C22H21O2P.C14H17ClN2O2.C14H15ClN2O2.2C11H11ClN2O2.C11H9ClN2O.C10H11ClN2O.2C9H7ClN2O2.C6H4ClNO.C3H5N3O2.C2H5Br/c1-2-24-22(23)18-25(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21;2*1-3-17-11(6-8-13(18)19-4-2)9-10-5-7-12(15)16-14(10)17;1-3-14-8-5-10(12)13-6-7(8)4-9(14)11(15)16-2;1-3-14-8(11(15)16-2)6-7-4-5-9(12)13-10(7)14;12-10-4-1-7-5-8-2-3-9(15)6-14(8)11(7)13-10;1-2-13-8(6-14)5-7-3-4-9(11)12-10(7)13;1-14-9(13)7-2-5-4-11-8(10)3-6(5)12-7;1-14-9(13)6-4-5-2-3-7(10)12-8(5)11-6;7-6-2-1-5(4-9)3-8-6;1-8-3(7)2-5-6-4;1-2-3/h3-18H,2H2,1H3;5,7,9H,3-4,6,8H2,1-2H3;5-9H,3-4H2,1-2H3;2*4-6H,3H2,1-2H3;1,4-5H,2-3,6H2;3-5,14H,2,6H2,1H3;2-4,12H,1H3;2-4H,1H3,(H,11,12);1-4H;2H2,1H3;2H2,1H3/b;;8-6+;;;;;;;;;.
What are the key properties of Bromoethane;2-chloro-7,9-dihydro-6H-pyrido[3,2-b]indolizin-8-one;(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol;6-chloropyridine-3-carbaldehyde;ethyl 3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)propanoate;ethyl (E)-3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl 2-azidoacetate;methyl 6-chloro-1-ethylpyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1-ethylpyrrolo[3,2-c]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate?
Bromoethane;2-chloro-7,9-dihydro-6H-pyrido[3,2-b]indolizin-8-one;(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol;6-chloropyridine-3-carbaldehyde;ethyl 3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)propanoate;ethyl (E)-3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl 2-azidoacetate;methyl 6-chloro-1-ethylpyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1-ethylpyrrolo[3,2-c]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate has a molecular weight of 2603.40 g/mol, XLogP of 26.66, 25 rotatable bonds, 3 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for Bromoethane;2-chloro-7,9-dihydro-6H-pyrido[3,2-b]indolizin-8-one;(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol;6-chloropyridine-3-carbaldehyde;ethyl 3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)propanoate;ethyl (E)-3-(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl 2-azidoacetate;methyl 6-chloro-1-ethylpyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1-ethylpyrrolo[3,2-c]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate;methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate is sourced from PubChem (CID 157159421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).
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Sources
- PubChem CID 157159421 — identifiers, structure, computed properties (public domain)
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