5-bromo-8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinoline;2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoic acid;2-[[2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoyl]amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoic acid;methyl 2-amino-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoate;methyl 3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (Z)-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;2,2,2-trifluoroacetic acid

C172H180BrF9N14O40S2 — CID 164969816

About 5-bromo-8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinoline;2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoic acid;2-[[2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoyl]amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoic acid;methyl 2-amino-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoate;methyl 3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (Z)-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;2,2,2-trifluoroacetic acid

5-bromo-8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinoline;2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoic acid;2-[[2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoyl]amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoic acid;methyl 2-amino-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoate;methyl 3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (Z)-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;2,2,2-trifluoroacetic acid (PubChem CID 164969816) has the molecular formula C172H180BrF9N14O40S2 and a molecular weight of 3398.41 g/mol. Its IUPAC name is 5-bromo-8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinoline;2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoic acid;2-[[2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoyl]amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoic acid;methyl 2-amino-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoate;methyl 3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (Z)-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;2,2,2-trifluoroacetic acid.

Molecular Properties

• Compound Name: 5-bromo-8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinoline;2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoic acid;2-[[2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoyl]amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoic acid;methyl 2-amino-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoate;methyl 3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (Z)-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;2,2,2-trifluoroacetic acid
• PubChem CID: 164969816
• Molecular Formula: C172H180BrF9N14O40S2
• Molecular Weight: 3398.41 g/mol
• Exact Mass: 3395.10
• IUPAC Name: 5-bromo-8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinoline;2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoic acid;2-[[2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoyl]amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoic acid;methyl 2-amino-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoate;methyl 3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (Z)-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;2,2,2-trifluoroacetic acid
• SMILES: C=C(NC(=O)OC(C)(C)C)C(=O)OC.CCOCc1cc(OC)c(-c2ccc(/C=C(\NC(=O)OC(C)(C)C)C(=O)OC)c3ccncc23)c(OC)c1.CCOCc1cc(OC)c(-c2ccc(Br)c3ccncc23)c(OC)c1.CCOCc1cc(OC)c(-c2ccc(CC(N)C(=O)OC)c3ccncc23)c(OC)c1.CCOCc1cc(OC)c(-c2ccc(CC(NC(=O)OC(C)(C)C)C(=O)OC)c3ccncc23)c(OC)c1.CCOCc1cc(OC)c(-c2ccc(CC(NC(=O)c3c(F)cc(NS(=O)(=O)c4ccc(-c5ccnc(F)c5)cc4)cc3F)C(=O)O)c3ccncc23)c(OC)c1.O=C(O)C(F)(F)F.O=C(O)c1c(F)cc(NS(=O)(=O)c2ccc(-c3ccnc(F)c3)cc2)cc1F
• InChI: InChI=1S/C41H35F3N4O8S.C29H36N2O7.C29H34N2O7.C24H28N2O5.C20H20BrNO3.C18H11F3N2O4S.C9H15NO4.C2HF3O2/c1-4-56-22-23-15-35(54-2)38(36(16-23)55-3)30-10-7-26(29-12-13-45-21-31(29)30)17-34(41(50)51)47-40(49)39-32(42)19-27(20-33(39)43)48-57(52,53)28-8-5-24(6-9-28)25-11-14-46-37(44)18-25;2*1-8-37-17-18-13-24(34-5)26(25(14-18)35-6)21-10-9-19(20-11-12-30-16-22(20)21)15-23(27(32)36-7)31-28(33)38-29(2,3)4;1-5-31-14-15-10-21(28-2)23(22(11-15)29-3)18-7-6-16(12-20(25)24(27)30-4)17-8-9-26-13-19(17)18;1-4-25-12-13-9-18(23-2)20(19(10-13)24-3)15-5-6-17(21)14-7-8-22-11-16(14)15;19-14-8-12(9-15(20)17(14)18(24)25)23-28(26,27)13-3-1-10(2-4-13)11-5-6-22-16(21)7-11;1-6(7(11)13-5)10-8(12)14-9(2,3)4;3-2(4,5)1(6)7/h5-16,18-21,34,48H,4,17,22H2,1-3H3,(H,47,49)(H,50,51);9-14,16,23H,8,15,17H2,1-7H3,(H,31,33);9-16H,8,17H2,1-7H3,(H,31,33);6-11,13,20H,5,12,14,25H2,1-4H3;5-11H,4,12H2,1-3H3;1-9,23H,(H,24,25);1H2,2-5H3,(H,10,12);(H,6,7)/b;;23-15-
• InChIKey: FSLKTWUEIARNNP-NGSIZGMUSA-N
• XLogP: 31.93
• TPSA: 708.23 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 45
• Rotatable Bonds: 56
• Heavy Atoms: 238
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3398.41
LogP ≤ 5	31.93
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	45

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-bromo-8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinoline;2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoic acid;2-[[2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoyl]amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoic acid;methyl 2-amino-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoate;methyl 3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (Z)-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;2,2,2-trifluoroacetic acid?

The IUPAC name of 5-bromo-8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinoline;2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoic acid;2-[[2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoyl]amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoic acid;methyl 2-amino-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoate;methyl 3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (Z)-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;2,2,2-trifluoroacetic acid (CID 164969816) is 5-bromo-8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinoline;2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoic acid;2-[[2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoyl]amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoic acid;methyl 2-amino-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoate;methyl 3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (Z)-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;2,2,2-trifluoroacetic acid.

What is the SMILES notation for 5-bromo-8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinoline;2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoic acid;2-[[2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoyl]amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoic acid;methyl 2-amino-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoate;methyl 3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (Z)-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;2,2,2-trifluoroacetic acid?

The canonical SMILES for 5-bromo-8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinoline;2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoic acid;2-[[2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoyl]amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoic acid;methyl 2-amino-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoate;methyl 3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (Z)-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;2,2,2-trifluoroacetic acid is C=C(NC(=O)OC(C)(C)C)C(=O)OC.CCOCc1cc(OC)c(-c2ccc(/C=C(\NC(=O)OC(C)(C)C)C(=O)OC)c3ccncc23)c(OC)c1.CCOCc1cc(OC)c(-c2ccc(Br)c3ccncc23)c(OC)c1.CCOCc1cc(OC)c(-c2ccc(CC(N)C(=O)OC)c3ccncc23)c(OC)c1.CCOCc1cc(OC)c(-c2ccc(CC(NC(=O)OC(C)(C)C)C(=O)OC)c3ccncc23)c(OC)c1.CCOCc1cc(OC)c(-c2ccc(CC(NC(=O)c3c(F)cc(NS(=O)(=O)c4ccc(-c5ccnc(F)c5)cc4)cc3F)C(=O)O)c3ccncc23)c(OC)c1.O=C(O)C(F)(F)F.O=C(O)c1c(F)cc(NS(=O)(=O)c2ccc(-c3ccnc(F)c3)cc2)cc1F.

What is the InChIKey of 5-bromo-8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinoline;2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoic acid;2-[[2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoyl]amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoic acid;methyl 2-amino-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoate;methyl 3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (Z)-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;2,2,2-trifluoroacetic acid?

The InChIKey is FSLKTWUEIARNNP-NGSIZGMUSA-N. The full InChI is InChI=1S/C41H35F3N4O8S.C29H36N2O7.C29H34N2O7.C24H28N2O5.C20H20BrNO3.C18H11F3N2O4S.C9H15NO4.C2HF3O2/c1-4-56-22-23-15-35(54-2)38(36(16-23)55-3)30-10-7-26(29-12-13-45-21-31(29)30)17-34(41(50)51)47-40(49)39-32(42)19-27(20-33(39)43)48-57(52,53)28-8-5-24(6-9-28)25-11-14-46-37(44)18-25;2*1-8-37-17-18-13-24(34-5)26(25(14-18)35-6)21-10-9-19(20-11-12-30-16-22(20)21)15-23(27(32)36-7)31-28(33)38-29(2,3)4;1-5-31-14-15-10-21(28-2)23(22(11-15)29-3)18-7-6-16(12-20(25)24(27)30-4)17-8-9-26-13-19(17)18;1-4-25-12-13-9-18(23-2)20(19(10-13)24-3)15-5-6-17(21)14-7-8-22-11-16(14)15;19-14-8-12(9-15(20)17(14)18(24)25)23-28(26,27)13-3-1-10(2-4-13)11-5-6-22-16(21)7-11;1-6(7(11)13-5)10-8(12)14-9(2,3)4;3-2(4,5)1(6)7/h5-16,18-21,34,48H,4,17,22H2,1-3H3,(H,47,49)(H,50,51);9-14,16,23H,8,15,17H2,1-7H3,(H,31,33);9-16H,8,17H2,1-7H3,(H,31,33);6-11,13,20H,5,12,14,25H2,1-4H3;5-11H,4,12H2,1-3H3;1-9,23H,(H,24,25);1H2,2-5H3,(H,10,12);(H,6,7)/b;;23-15-;;;;;.

What are the key properties of 5-bromo-8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinoline;2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoic acid;2-[[2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoyl]amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoic acid;methyl 2-amino-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoate;methyl 3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (Z)-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;2,2,2-trifluoroacetic acid?

5-bromo-8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinoline;2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoic acid;2-[[2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoyl]amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoic acid;methyl 2-amino-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoate;methyl 3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (Z)-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;2,2,2-trifluoroacetic acid has a molecular weight of 3398.41 g/mol, XLogP of 31.93, 56 rotatable bonds, 10 hydrogen bond donors, and 45 hydrogen bond acceptors.

Where does this data come from?

All data for 5-bromo-8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinoline;2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoic acid;2-[[2,6-difluoro-4-[[4-(2-fluoro-4-pyridinyl)phenyl]sulfonylamino]benzoyl]amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoic acid;methyl 2-amino-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]propanoate;methyl 3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;methyl (Z)-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]isoquinolin-5-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate;2,2,2-trifluoroacetic acid is sourced from PubChem (CID 164969816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).