1-氨基-4-[[3-[[4-氯-6-[(3-磺苯基)氨基]-1,3,5-三嗪-2-基]氨基]-4-磺苯基]氨基]-9,10-二氢-9,10-二氧代-2-蒽磺酸三钠盐

pro_cas
23422-12-0
pro_cdbregno
CCD08272985
pro_formula
C29 H17 Cl N7 O11 S3 . 3 Na
pro_molWeight
840.112

basic_info

Product_Name: 1-氨基-4-[[3-[[4-氯-6-[(3-磺苯基)氨基]-1,3,5-三嗪-2-基]氨基]-4-磺苯基]氨基]-9,10-二氢-9,10-二氧代-2-蒽磺酸三钠盐
CAS: 23422-12-0
中文同义词: 1-氨基-4-[3-[[4-氯-6-(3-磺酸根苯胺基)-1,3,5-三嗪-2-基]氨基]-4-磺酸根苯胺基]-9,10-二氢-9,10-二羰基蒽-2-磺化三钠 ; 1-氨基-4-[[3-[[4-氯-6-[(3-磺苯基)氨基]-1,3,5-三嗪-2-基]氨基]-4-磺苯基]氨基]-9,10-二氢-9,10-二氧代-2-蒽磺酸三钠盐
EnglishSynonyms: TRISODIUM 1-AMINO-4-[3-[[4-CHLORO-6-(3-SULPHONATOANILINO)-1,3,5-TRIAZIN-2-YL]AMINO]-4-SULPHONATOANILINO]-9,10-DIHYDRO-9,10-DIOXOANTHRACENE-2-SULPHONATE ; TRISODIUM 1-AMINO-4-[[3-([4-CHLORO-6-[(3-SULFONATOPHENYL)AMINO]-1,3,5-TRIAZIN-2-YL]AMINO)-4-SULFONATOPHENYL]AMINO]-9,10-DIOXO-9,10-DIHYDRO-2-ANTHRACENESULFONATE
pro_mdlNumber: MFCD23142696
pro_acceptors: 18
pro_donors: 4
pro_smile: c1ccc2c(c1)C(=O)c3c(cc(c(c3C2=O)N)S(=O)(=O)[O-])Nc4ccc(c(c4)Nc5nc(nc(n5)Cl)Nc6cccc(c6)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]
InChi: InChI=1S/C29H20ClN7O11S3.3Na/c30-27-35-28(33-13-4-3-5-15(10-13)49(40,41)42)37-29(36-27)34-18-11-14(8-9-20(18)50(43,44)45)32-19-12-21(51(46,47)48)24(31)23-22(19)25(38)16-6-1-2-7-17(16)26(23)39;;;/h1-12,32H,31H2,(H,40,41,42)(H,43,44,45)(H,46,47,48)(H2,33,34,35,36,37);;;/q;3*+1/p-3
InChiKey: InChIKey=ROHGQIQUQCTSOK-UHFFFAOYSA-K

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