3-(3-SULFOPROPYL)-2-([3-[(3-ETHYL-2-BENZOTHIAZOLINYLIDENE)METHYL]-5,5-DIMETHYL-2-CYCLOHEXEN-1-YLIDENE]METHYL) BENZOTHIAZOLIUM INNER SALT

CAS号
CCD编号
CCD00070831
分子式
C29 H32 N2 O3 S3
分子量
552.781

基本信息

产品名称: 3-(3-SULFOPROPYL)-2-([3-[(3-ETHYL-2-BENZOTHIAZOLINYLIDENE)METHYL]-5,5-DIMETHYL-2-CYCLOHEXEN-1-YLIDENE]METHYL) BENZOTHIAZOLIUM INNER SALT
英文同义词: 3-(3-SULFOPROPYL)-2-([3-[(3-ETHYL-2-BENZOTHIAZOLINYLIDENE)METHYL]-5,5-DIMETHYL-2-CYCLOHEXEN-1-YLIDENE]METHYL) BENZOTHIAZOLIUM INNER SALT
MDL号: MFCD00143047
氢键受体数量: 5
氢键供体数量: 0
Smile: CCN\1c2ccccc2S/C1=C\C3=C/C(=C/c4[n+](c5ccccc5s4)CCCS(=O)(=O)[O-])/CC(C3)(C)C
InChi: InChI=1S/C29H32N2O3S3/c1-4-30-23-10-5-7-12-25(23)35-27(30)17-21-16-22(20-29(2,3)19-21)18-28-31(14-9-15-37(32,33)34)24-11-6-8-13-26(24)36-28/h5-8,10-13,16-18H,4,9,14-15,19-20H2,1-3H3
InChiKey: InChIKey=YRFUOEGOPWKHQT-UHFFFAOYSA-N

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