About (3,4-dimethyl-2,3-dihydro-1,4-benzoxazin-7-yl)-(1,2-dimethylpyrazol-1-ium-3-yl)diazene;(1,2-dimethyl-2,3-dihydroindol-5-yl)-(1,2,5-trimethylpyrazol-2-ium-3-yl)diazene;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N,N-dimethylaniline;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N-methylaniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline;4-[(2,4-dimethyl-1,2,4-triazol-4-ium-3-yl)diazenyl]aniline;4-[2-(1-ethenylpyridin-1-ium-4-yl)ethenyl]-N,N,3-trimethylaniline;methane;3-[N-methyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]propanenitrile;4-methyl-7-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]-2,3-dihydro-1,4-benzoxazine;molecular hydrogen;hydrate
(3,4-dimethyl-2,3-dihydro-1,4-benzoxazin-7-yl)-(1,2-dimethylpyrazol-1-ium-3-yl)diazene;(1,2-dimethyl-2,3-dihydroindol-5-yl)-(1,2,5-trimethylpyrazol-2-ium-3-yl)diazene;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N,N-dimethylaniline;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N-methylaniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline;4-[(2,4-dimethyl-1,2,4-triazol-4-ium-3-yl)diazenyl]aniline;4-[2-(1-ethenylpyridin-1-ium-4-yl)ethenyl]-N,N,3-trimethylaniline;methane;3-[N-methyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]propanenitrile;4-methyl-7-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]-2,3-dihydro-1,4-benzoxazine;molecular hydrogen;hydrate (PubChem CID 158136578) has the molecular formula C152H195N37O3+10
and a molecular weight of 2588.49 g/mol. Its IUPAC name is (3,4-dimethyl-2,3-dihydro-1,4-benzoxazin-7-yl)-(1,2-dimethylpyrazol-1-ium-3-yl)diazene;(1,2-dimethyl-2,3-dihydroindol-5-yl)-(1,2,5-trimethylpyrazol-2-ium-3-yl)diazene;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N,N-dimethylaniline;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N-methylaniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline;4-[(2,4-dimethyl-1,2,4-triazol-4-ium-3-yl)diazenyl]aniline;4-[2-(1-ethenylpyridin-1-ium-4-yl)ethenyl]-N,N,3-trimethylaniline;methane;3-[N-methyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]propanenitrile;4-methyl-7-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]-2,3-dihydro-1,4-benzoxazine;molecular hydrogen;hydrate.
Frequently Asked Questions
What is the IUPAC name of (3,4-dimethyl-2,3-dihydro-1,4-benzoxazin-7-yl)-(1,2-dimethylpyrazol-1-ium-3-yl)diazene;(1,2-dimethyl-2,3-dihydroindol-5-yl)-(1,2,5-trimethylpyrazol-2-ium-3-yl)diazene;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N,N-dimethylaniline;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N-methylaniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline;4-[(2,4-dimethyl-1,2,4-triazol-4-ium-3-yl)diazenyl]aniline;4-[2-(1-ethenylpyridin-1-ium-4-yl)ethenyl]-N,N,3-trimethylaniline;methane;3-[N-methyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]propanenitrile;4-methyl-7-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]-2,3-dihydro-1,4-benzoxazine;molecular hydrogen;hydrate?
The IUPAC name of (3,4-dimethyl-2,3-dihydro-1,4-benzoxazin-7-yl)-(1,2-dimethylpyrazol-1-ium-3-yl)diazene;(1,2-dimethyl-2,3-dihydroindol-5-yl)-(1,2,5-trimethylpyrazol-2-ium-3-yl)diazene;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N,N-dimethylaniline;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N-methylaniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline;4-[(2,4-dimethyl-1,2,4-triazol-4-ium-3-yl)diazenyl]aniline;4-[2-(1-ethenylpyridin-1-ium-4-yl)ethenyl]-N,N,3-trimethylaniline;methane;3-[N-methyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]propanenitrile;4-methyl-7-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]-2,3-dihydro-1,4-benzoxazine;molecular hydrogen;hydrate (CID 158136578) is (3,4-dimethyl-2,3-dihydro-1,4-benzoxazin-7-yl)-(1,2-dimethylpyrazol-1-ium-3-yl)diazene;(1,2-dimethyl-2,3-dihydroindol-5-yl)-(1,2,5-trimethylpyrazol-2-ium-3-yl)diazene;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N,N-dimethylaniline;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N-methylaniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline;4-[(2,4-dimethyl-1,2,4-triazol-4-ium-3-yl)diazenyl]aniline;4-[2-(1-ethenylpyridin-1-ium-4-yl)ethenyl]-N,N,3-trimethylaniline;methane;3-[N-methyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]propanenitrile;4-methyl-7-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]-2,3-dihydro-1,4-benzoxazine;molecular hydrogen;hydrate.
What is the SMILES notation for (3,4-dimethyl-2,3-dihydro-1,4-benzoxazin-7-yl)-(1,2-dimethylpyrazol-1-ium-3-yl)diazene;(1,2-dimethyl-2,3-dihydroindol-5-yl)-(1,2,5-trimethylpyrazol-2-ium-3-yl)diazene;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N,N-dimethylaniline;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N-methylaniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline;4-[(2,4-dimethyl-1,2,4-triazol-4-ium-3-yl)diazenyl]aniline;4-[2-(1-ethenylpyridin-1-ium-4-yl)ethenyl]-N,N,3-trimethylaniline;methane;3-[N-methyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]propanenitrile;4-methyl-7-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]-2,3-dihydro-1,4-benzoxazine;molecular hydrogen;hydrate?
The canonical SMILES for (3,4-dimethyl-2,3-dihydro-1,4-benzoxazin-7-yl)-(1,2-dimethylpyrazol-1-ium-3-yl)diazene;(1,2-dimethyl-2,3-dihydroindol-5-yl)-(1,2,5-trimethylpyrazol-2-ium-3-yl)diazene;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N,N-dimethylaniline;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N-methylaniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline;4-[(2,4-dimethyl-1,2,4-triazol-4-ium-3-yl)diazenyl]aniline;4-[2-(1-ethenylpyridin-1-ium-4-yl)ethenyl]-N,N,3-trimethylaniline;methane;3-[N-methyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]propanenitrile;4-methyl-7-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]-2,3-dihydro-1,4-benzoxazine;molecular hydrogen;hydrate is C.C=C[n+]1ccc(C=Cc2ccc(N(C)C)cc2C)cc1.CC1COc2cc(/N=N/c3cc[n+](C)n3C)ccc2N1C.CN(C)c1ccc(/N=N/c2n(C)cc[n+]2C)cc1.CN(C)c1ccc(C=Cc2cc[n+](C)cc2)cc1.CN(C)c1ccc(C=Cc2cccc[n+]2C)cc1.CN(CCC#N)c1ccc(C=Cc2cc[n+](C)cc2)cc1.CN1CCOc2cc(C=Cc3cc[n+](C)cc3)ccc21.CNc1ccc(/N=N/c2n(C)cc[n+]2C)cc1.Cc1cc(/N=N/c2ccc3c(c2)CC(C)N3C)[n+](C)n1C.Cn1nc[n+](C)c1/N=N/c1ccc(N)cc1.O.[H][H].
What is the InChIKey of (3,4-dimethyl-2,3-dihydro-1,4-benzoxazin-7-yl)-(1,2-dimethylpyrazol-1-ium-3-yl)diazene;(1,2-dimethyl-2,3-dihydroindol-5-yl)-(1,2,5-trimethylpyrazol-2-ium-3-yl)diazene;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N,N-dimethylaniline;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N-methylaniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline;4-[(2,4-dimethyl-1,2,4-triazol-4-ium-3-yl)diazenyl]aniline;4-[2-(1-ethenylpyridin-1-ium-4-yl)ethenyl]-N,N,3-trimethylaniline;methane;3-[N-methyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]propanenitrile;4-methyl-7-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]-2,3-dihydro-1,4-benzoxazine;molecular hydrogen;hydrate?
The InChIKey is FTKODDAQEOJHAF-UHFFFAOYSA-P. The full InChI is InChI=1S/C18H20N3.C18H21N2.C17H19N2O.C16H22N5.2C16H19N2.C15H20N5O.C13H18N5.C12H15N5.C10H12N6.CH4.H2O.H2/c1-20-14-10-17(11-15-20)5-4-16-6-8-18(9-7-16)21(2)13-3-12-19;1-5-20-12-10-16(11-13-20)6-7-17-8-9-18(19(3)4)14-15(17)2;1-18-9-7-14(8-10-18)3-4-15-5-6-16-17(13-15)20-12-11-19(16)2;1-11-8-13-10-14(6-7-15(13)19(11)3)17-18-16-9-12(2)20(4)21(16)5;1-17(2)16-8-6-14(7-9-16)4-5-15-10-12-18(3)13-11-15;1-17(2)15-10-7-14(8-11-15)9-12-16-6-4-5-13-18(16)3;1-11-10-21-14-9-12(5-6-13(14)19(11)3)16-17-15-7-8-18(2)20(15)4;1-16(2)12-7-5-11(6-8-12)14-15-13-17(3)9-10-18(13)4;1-13-10-4-6-11(7-5-10)14-15-12-16(2)8-9-17(12)3;1-15-7-12-16(2)10(15)14-13-9-5-3-8(11)4-6-9;;;/h4-11,14-15H,3,13H2,1-2H3;5-14H,1H2,2-4H3;3-10,13H,11-12H2,1-2H3;6-7,9-11H,8H2,1-5H3;2*4-13H,1-3H3;5-9,11H,10H2,1-4H3;5-10H,1-4H3;4-9H,1-3H3;3-7,11H,1-2H3;1H4;1H2;1H/q8*+1;;;;;/p+2.
What are the key properties of (3,4-dimethyl-2,3-dihydro-1,4-benzoxazin-7-yl)-(1,2-dimethylpyrazol-1-ium-3-yl)diazene;(1,2-dimethyl-2,3-dihydroindol-5-yl)-(1,2,5-trimethylpyrazol-2-ium-3-yl)diazene;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N,N-dimethylaniline;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N-methylaniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline;4-[(2,4-dimethyl-1,2,4-triazol-4-ium-3-yl)diazenyl]aniline;4-[2-(1-ethenylpyridin-1-ium-4-yl)ethenyl]-N,N,3-trimethylaniline;methane;3-[N-methyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]propanenitrile;4-methyl-7-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]-2,3-dihydro-1,4-benzoxazine;molecular hydrogen;hydrate?
(3,4-dimethyl-2,3-dihydro-1,4-benzoxazin-7-yl)-(1,2-dimethylpyrazol-1-ium-3-yl)diazene;(1,2-dimethyl-2,3-dihydroindol-5-yl)-(1,2,5-trimethylpyrazol-2-ium-3-yl)diazene;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N,N-dimethylaniline;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N-methylaniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline;4-[(2,4-dimethyl-1,2,4-triazol-4-ium-3-yl)diazenyl]aniline;4-[2-(1-ethenylpyridin-1-ium-4-yl)ethenyl]-N,N,3-trimethylaniline;methane;3-[N-methyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]propanenitrile;4-methyl-7-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]-2,3-dihydro-1,4-benzoxazine;molecular hydrogen;hydrate has a molecular weight of 2588.49 g/mol, XLogP of 26.03, 29 rotatable bonds, 2 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dimethyl-2,3-dihydro-1,4-benzoxazin-7-yl)-(1,2-dimethylpyrazol-1-ium-3-yl)diazene;(1,2-dimethyl-2,3-dihydroindol-5-yl)-(1,2,5-trimethylpyrazol-2-ium-3-yl)diazene;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N,N-dimethylaniline;4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N-methylaniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N,N-dimethyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline;4-[(2,4-dimethyl-1,2,4-triazol-4-ium-3-yl)diazenyl]aniline;4-[2-(1-ethenylpyridin-1-ium-4-yl)ethenyl]-N,N,3-trimethylaniline;methane;3-[N-methyl-4-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]propanenitrile;4-methyl-7-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]-2,3-dihydro-1,4-benzoxazine;molecular hydrogen;hydrate is sourced from PubChem (CID 158136578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).