4-[4-[[2,5-二甲氧基-4-[[2-(磺酰氧基)乙基]磺酰基]苯基]偶氮]-4,5-二氢-3-甲基-5-氧代-1H-吡唑-1-基]-苯磺酸钠盐

CAS号
62121-76-0
CCD编号
CCD08276028
分子式
C20 H20 N4 O12 S3 . 2 Na
分子量
650.572

基本信息

产品名称: 4-[4-[[2,5-二甲氧基-4-[[2-(磺酰氧基)乙基]磺酰基]苯基]偶氮]-4,5-二氢-3-甲基-5-氧代-1H-吡唑-1-基]-苯磺酸钠盐
CAS: 62121-76-0
中文同义词: 4-[4-[[2,5-二甲氧基-4-[[2-(磺酰氧基)乙基]磺酰基]苯基]偶氮]-4,5-二氢-3-甲基-5-氧代-1H-吡唑-1-基]-苯磺酸钠盐
英文同义词: 4-[4-[[2,5-DIMETHOXY-4-[[2-(SULPHOOXY)ETHYL]SULPHONYL]PHENYL]AZO]-4,5-DIHYDRO-3-METHYL-5-OXO-1H-PYRAZOL-1-YL]BENZENESULPHONIC ACID SODIUM SALT ; DISODIUM 4-[4-[(E)-(2,5-DIMETHOXY-4-[[2-(SULFONATOOXY)ETHYL]SULFONYL]PHENYL)DIAZENYL]-3-METHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOL-1-YL]BENZENESULFONATE
MDL号: MFCD23160527
氢键受体数量: 16
氢键供体数量: 0
Smile: CC1=NN(C(=O)C1/N=N/c2cc(c(cc2OC)S(=O)(=O)CCOS(=O)(=O)[O-])OC)c3ccc(cc3)S(=O)(=O)[O-].[Na+].[Na+]
InChi: InChI=1S/C20H22N4O12S3.2Na/c1-12-19(20(25)24(23-12)13-4-6-14(7-5-13)38(28,29)30)22-21-15-10-17(35-3)18(11-16(15)34-2)37(26,27)9-8-36-39(31,32)33;;/h4-7,10-11,19H,8-9H2,1-3H3,(H,28,29,30)(H,31,32,33);;/q;2*+1/p-2/b22-21+;;
InChiKey: InChIKey=JDPMQBDNRSLOKS-ZPZFBZIMSA-L

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