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ACID BLUE 104

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Name: ACID BLUE 104
CAS: 6505-30-2
Synonyms: ACID BLUE 104
MDL.: MFCD00231010
H bond acceptor: 9
H bond donor: 0
Smile: CCN(CC)c1ccc(cc1)/C(=C/2\C=C/C(=[N+](/CC)\Cc3cccc(c3)S(=O)(=O)[O-])/C=C2C)/c4ccc(cc4C)N(CC)Cc5cccc(c5)S(=O)(=O)[O-].[Na+]
InChi: InChI=1S/C43H49N3O6S2.Na/c1-7-44(8-2)36-19-17-35(18-20-36)43(41-23-21-37(25-31(41)5)45(9-3)29-33-13-11-15-39(27-33)53(47,48)49)42-24-22-38(26-32(42)6)46(10-4)30-34-14-12-16-40(28-34)54(50,51)52;/h11-28H,7-10,29-30H2,1-6H3,(H-,47,48,49,50,51,52);/q;+1/p-1
InChiKey: InChIKey=RAMNYUMITLZMIC-UHFFFAOYSA-M

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