酸性蓝9二铵盐（c.i. 42090） acid blue 9 diammonium salt (c.i. 42090)
右键点击后面的免费Jmol Molecule链接获取更多信息 Right Click Free Jmol Molecule For More Options. 戳 Click 这里 Here.
iupac名称 IUPAC Name :diazanium;2-[[4-[ethyl-[(3-sulfonatophenyl)methyl]amino]phenyl]-[4-[ethyl-[(3-sulfonatophenyl)methyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]methyl]benzenes
INCHI InChI :INCHI InChI=1/C37H36N2O9S3.2H3N/c1-3-38(25-27-9-7-11-33(23-27)49(40,41)42)31-19-15-29(16-20-31)37(35-13-5-6-14-36(35)51(46,47)48)30-17-21-32(22-18-30)39(4-2)26-28-10-8-12-34(24-28)50(43,44)45;;/h5-24H,3-4,25-26H2,1-2 3 1-2H3,(H2-,40,41,42,43,44,45,46,47,48);2*1H3
印地 Std.InChI: INCHI InChI=1S/C37H36N2O9S3.2H3N/c1-3-38(25-27-9-7-11-33(23-27)49(40,41)42)31-19-15-29(16-20-31)37(35-13-5-6-14-36(35)51(46,47)48)30-17-21-32(22-18-30)39(4-2)26-28-10-8-12-34(24-28)50(43,44)45;;/h5-24H,3-4,25-26H2,1-2 3 1-2H3,(H2-,40,41,42,43,44,45,46,47,48);2*1H3
INCHI基 InChIKey :HMEKVHWROSNWPD-UHFFFAOYAC
标准奇奇 Std.InChIKey: HMEKVHWROSNWPD-UHFFFAOYSA-N
微笑 SMILES :[o- O-]S(= o =O)(= o =O)c1cccc(c1)cn CN(c2ccc(cc2)/C(= c =C\4/c = c C= c =C\C(=[N+](\cc CC)Cc3cccc(c3)S([o- O-])(= o =O)= o =O)/c = c C= c =C/4)c5ccccc5S([o- O-])(= o =O)= o =O)cc CC.[NH4+].[NH4+]