About lithium;[3-[(1R,2S)-1-cyclopropyl-3-methoxy-2-methyl-3-oxopropyl]phenyl] 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;2,4-dimethylpentane;5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoic acid;(5-fluoro-2-methoxy-4-pyridinyl)boronic acid;methane;methyl (2S,3R)-3-cyclopropyl-3-(3-hydroxyphenyl)-2-methylpropanoate;methyl 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;methyl 4-(5-fluoro-2-methoxy-4-pyridinyl)-5-formyl-2-methylbenzoate;methyl 5-formyl-2,4-dimethylbenzoate;methyl 5-formyl-4-hydroxy-2-methylbenzoate;methyl 4-hydroxy-2-methylbenzoate;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylsulfonyl)methanesulfonamide;hydroxide;hydrate
lithium;[3-[(1R,2S)-1-cyclopropyl-3-methoxy-2-methyl-3-oxopropyl]phenyl] 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;2,4-dimethylpentane;5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoic acid;(5-fluoro-2-methoxy-4-pyridinyl)boronic acid;methane;methyl (2S,3R)-3-cyclopropyl-3-(3-hydroxyphenyl)-2-methylpropanoate;methyl 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;methyl 4-(5-fluoro-2-methoxy-4-pyridinyl)-5-formyl-2-methylbenzoate;methyl 5-formyl-2,4-dimethylbenzoate;methyl 5-formyl-4-hydroxy-2-methylbenzoate;methyl 4-hydroxy-2-methylbenzoate;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylsulfonyl)methanesulfonamide;hydroxide;hydrate (PubChem CID 164968990) has the molecular formula C162H206BF11LiN9O37S2
and a molecular weight of 3162.32 g/mol. Its IUPAC name is lithium;[3-[(1R,2S)-1-cyclopropyl-3-methoxy-2-methyl-3-oxopropyl]phenyl] 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;2,4-dimethylpentane;5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoic acid;(5-fluoro-2-methoxy-4-pyridinyl)boronic acid;methane;methyl (2S,3R)-3-cyclopropyl-3-(3-hydroxyphenyl)-2-methylpropanoate;methyl 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;methyl 4-(5-fluoro-2-methoxy-4-pyridinyl)-5-formyl-2-methylbenzoate;methyl 5-formyl-2,4-dimethylbenzoate;methyl 5-formyl-4-hydroxy-2-methylbenzoate;methyl 4-hydroxy-2-methylbenzoate;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylsulfonyl)methanesulfonamide;hydroxide;hydrate.
Frequently Asked Questions
What is the IUPAC name of lithium;[3-[(1R,2S)-1-cyclopropyl-3-methoxy-2-methyl-3-oxopropyl]phenyl] 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;2,4-dimethylpentane;5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoic acid;(5-fluoro-2-methoxy-4-pyridinyl)boronic acid;methane;methyl (2S,3R)-3-cyclopropyl-3-(3-hydroxyphenyl)-2-methylpropanoate;methyl 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;methyl 4-(5-fluoro-2-methoxy-4-pyridinyl)-5-formyl-2-methylbenzoate;methyl 5-formyl-2,4-dimethylbenzoate;methyl 5-formyl-4-hydroxy-2-methylbenzoate;methyl 4-hydroxy-2-methylbenzoate;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylsulfonyl)methanesulfonamide;hydroxide;hydrate?
The IUPAC name of lithium;[3-[(1R,2S)-1-cyclopropyl-3-methoxy-2-methyl-3-oxopropyl]phenyl] 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;2,4-dimethylpentane;5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoic acid;(5-fluoro-2-methoxy-4-pyridinyl)boronic acid;methane;methyl (2S,3R)-3-cyclopropyl-3-(3-hydroxyphenyl)-2-methylpropanoate;methyl 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;methyl 4-(5-fluoro-2-methoxy-4-pyridinyl)-5-formyl-2-methylbenzoate;methyl 5-formyl-2,4-dimethylbenzoate;methyl 5-formyl-4-hydroxy-2-methylbenzoate;methyl 4-hydroxy-2-methylbenzoate;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylsulfonyl)methanesulfonamide;hydroxide;hydrate (CID 164968990) is lithium;[3-[(1R,2S)-1-cyclopropyl-3-methoxy-2-methyl-3-oxopropyl]phenyl] 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;2,4-dimethylpentane;5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoic acid;(5-fluoro-2-methoxy-4-pyridinyl)boronic acid;methane;methyl (2S,3R)-3-cyclopropyl-3-(3-hydroxyphenyl)-2-methylpropanoate;methyl 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;methyl 4-(5-fluoro-2-methoxy-4-pyridinyl)-5-formyl-2-methylbenzoate;methyl 5-formyl-2,4-dimethylbenzoate;methyl 5-formyl-4-hydroxy-2-methylbenzoate;methyl 4-hydroxy-2-methylbenzoate;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylsulfonyl)methanesulfonamide;hydroxide;hydrate.
What is the SMILES notation for lithium;[3-[(1R,2S)-1-cyclopropyl-3-methoxy-2-methyl-3-oxopropyl]phenyl] 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;2,4-dimethylpentane;5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoic acid;(5-fluoro-2-methoxy-4-pyridinyl)boronic acid;methane;methyl (2S,3R)-3-cyclopropyl-3-(3-hydroxyphenyl)-2-methylpropanoate;methyl 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;methyl 4-(5-fluoro-2-methoxy-4-pyridinyl)-5-formyl-2-methylbenzoate;methyl 5-formyl-2,4-dimethylbenzoate;methyl 5-formyl-4-hydroxy-2-methylbenzoate;methyl 4-hydroxy-2-methylbenzoate;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylsulfonyl)methanesulfonamide;hydroxide;hydrate?
The canonical SMILES for lithium;[3-[(1R,2S)-1-cyclopropyl-3-methoxy-2-methyl-3-oxopropyl]phenyl] 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;2,4-dimethylpentane;5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoic acid;(5-fluoro-2-methoxy-4-pyridinyl)boronic acid;methane;methyl (2S,3R)-3-cyclopropyl-3-(3-hydroxyphenyl)-2-methylpropanoate;methyl 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;methyl 4-(5-fluoro-2-methoxy-4-pyridinyl)-5-formyl-2-methylbenzoate;methyl 5-formyl-2,4-dimethylbenzoate;methyl 5-formyl-4-hydroxy-2-methylbenzoate;methyl 4-hydroxy-2-methylbenzoate;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylsulfonyl)methanesulfonamide;hydroxide;hydrate is C.C.C.CC(C)CC(C)C.COC(=O)[C@@H](C)[C@H](c1cccc(O)c1)C1CC1.COC(=O)[C@@H](C)[C@H](c1cccc(OC(=O)c2cc(CN(C(C)C)C(C)C)c(-c3cc(OC)ncc3F)cc2C)c1)C1CC1.COC(=O)c1cc(C=O)c(-c2cc(OC)ncc2F)cc1C.COC(=O)c1cc(C=O)c(C)cc1C.COC(=O)c1cc(C=O)c(O)cc1C.COC(=O)c1cc(CN(C(C)C)C(C)C)c(-c2cc(OC)ncc2F)cc1C.COC(=O)c1ccc(O)cc1C.COc1cc(-c2cc(C)c(C(=O)O)cc2CN(C(C)C)C(C)C)c(F)cn1.COc1cc(B(O)O)c(F)cn1.O.O=S(=O)(N(c1ccccc1)S(=O)(=O)C(F)(F)F)C(F)(F)F.[Li+].[OH-].
What is the InChIKey of lithium;[3-[(1R,2S)-1-cyclopropyl-3-methoxy-2-methyl-3-oxopropyl]phenyl] 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;2,4-dimethylpentane;5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoic acid;(5-fluoro-2-methoxy-4-pyridinyl)boronic acid;methane;methyl (2S,3R)-3-cyclopropyl-3-(3-hydroxyphenyl)-2-methylpropanoate;methyl 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;methyl 4-(5-fluoro-2-methoxy-4-pyridinyl)-5-formyl-2-methylbenzoate;methyl 5-formyl-2,4-dimethylbenzoate;methyl 5-formyl-4-hydroxy-2-methylbenzoate;methyl 4-hydroxy-2-methylbenzoate;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylsulfonyl)methanesulfonamide;hydroxide;hydrate?
The InChIKey is KHHOEWHPPOTZHK-SOFAOFRUSA-M. The full InChI is InChI=1S/C35H43FN2O5.C22H29FN2O3.C21H27FN2O3.C16H14FNO4.C14H18O3.C11H12O3.C10H10O4.C9H10O3.C8H5F6NO4S2.C7H16.C6H7BFNO3.3CH4.Li.2H2O/c1-20(2)38(21(3)4)19-26-16-28(22(5)14-29(26)30-17-32(41-7)37-18-31(30)36)35(40)43-27-11-9-10-25(15-27)33(24-12-13-24)23(6)34(39)42-8;1-13(2)25(14(3)4)12-16-9-17(22(26)28-7)15(5)8-18(16)19-10-21(27-6)24-11-20(19)23;1-12(2)24(13(3)4)11-15-8-16(21(25)26)14(5)7-17(15)18-9-20(27-6)23-10-19(18)22;1-9-4-12(10(8-19)5-11(9)16(20)22-3)13-6-15(21-2)18-7-14(13)17;1-9(14(16)17-2)13(10-6-7-10)11-4-3-5-12(15)8-11;1-7-4-8(2)10(11(13)14-3)5-9(7)6-12;1-6-3-9(12)7(5-11)4-8(6)10(13)14-2;1-6-5-7(10)3-4-8(6)9(11)12-2;9-7(10,11)20(16,17)15(6-4-2-1-3-5-6)21(18,19)8(12,13)14;1-6(2)5-7(3)4;1-12-6-2-4(7(10)11)5(8)3-9-6;;;;;;/h9-11,14-18,20-21,23-24,33H,12-13,19H2,1-8H3;8-11,13-14H,12H2,1-7H3;7-10,12-13H,11H2,1-6H3,(H,25,26);4-8H,1-3H3;3-5,8-10,13,15H,6-7H2,1-2H3;4-6H,1-3H3;3-5,12H,1-2H3;3-5,10H,1-2H3;1-5H;6-7H,5H2,1-4H3;2-3,10-11H,1H3;3*1H4;;2*1H2/q;;;;;;;;;;;;;;+1;;/p-1/t23-,33-;;;;9-,13-;;;;;;;;;;;;/m0...0............/s1.
What are the key properties of lithium;[3-[(1R,2S)-1-cyclopropyl-3-methoxy-2-methyl-3-oxopropyl]phenyl] 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;2,4-dimethylpentane;5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoic acid;(5-fluoro-2-methoxy-4-pyridinyl)boronic acid;methane;methyl (2S,3R)-3-cyclopropyl-3-(3-hydroxyphenyl)-2-methylpropanoate;methyl 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;methyl 4-(5-fluoro-2-methoxy-4-pyridinyl)-5-formyl-2-methylbenzoate;methyl 5-formyl-2,4-dimethylbenzoate;methyl 5-formyl-4-hydroxy-2-methylbenzoate;methyl 4-hydroxy-2-methylbenzoate;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylsulfonyl)methanesulfonamide;hydroxide;hydrate?
lithium;[3-[(1R,2S)-1-cyclopropyl-3-methoxy-2-methyl-3-oxopropyl]phenyl] 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;2,4-dimethylpentane;5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoic acid;(5-fluoro-2-methoxy-4-pyridinyl)boronic acid;methane;methyl (2S,3R)-3-cyclopropyl-3-(3-hydroxyphenyl)-2-methylpropanoate;methyl 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;methyl 4-(5-fluoro-2-methoxy-4-pyridinyl)-5-formyl-2-methylbenzoate;methyl 5-formyl-2,4-dimethylbenzoate;methyl 5-formyl-4-hydroxy-2-methylbenzoate;methyl 4-hydroxy-2-methylbenzoate;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylsulfonyl)methanesulfonamide;hydroxide;hydrate has a molecular weight of 3162.32 g/mol, XLogP of 28.37, 46 rotatable bonds, 6 hydrogen bond donors, and 43 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;[3-[(1R,2S)-1-cyclopropyl-3-methoxy-2-methyl-3-oxopropyl]phenyl] 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;2,4-dimethylpentane;5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoic acid;(5-fluoro-2-methoxy-4-pyridinyl)boronic acid;methane;methyl (2S,3R)-3-cyclopropyl-3-(3-hydroxyphenyl)-2-methylpropanoate;methyl 5-[[di(propan-2-yl)amino]methyl]-4-(5-fluoro-2-methoxy-4-pyridinyl)-2-methylbenzoate;methyl 4-(5-fluoro-2-methoxy-4-pyridinyl)-5-formyl-2-methylbenzoate;methyl 5-formyl-2,4-dimethylbenzoate;methyl 5-formyl-4-hydroxy-2-methylbenzoate;methyl 4-hydroxy-2-methylbenzoate;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylsulfonyl)methanesulfonamide;hydroxide;hydrate is sourced from PubChem (CID 164968990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).