2,7-Naphthalenedisulfonic acid, 3,3′-[1,2-ethanediylbis[imino(6-fluoro-1,3,5-triazine-4,2-diyl)imino(6-sulfo-3,1-phenylene)azo]]bis[4-amino-5-hydroxy-6-[(1-sulfo-2-naphthalenyl)azo]-, potassium sodium salt

Other Names and Identifiers

InChI

InChI=1S/C60H44F2N20O26S8.K.Na/c61-55-69-57(73-59(71-55)67-29-10-13-37(109(85,86)87)35(22-29)77-79-48-40(112(94,95)96)18-27-20-42(114(100,101)102)50(52(83)44(27)46(48)63)81-75-31-17-26-6-2-3-7-32(26)39(24-31)111(91,92)93)65-15-16-66-58-70-56(62)72-60(74-58)68-30-11-14-38(110(88,89)90)36(23-30)78-80-49-41(113(97,98)99)19-28-21-43(115(103,104)105)51(53(84)45(28)47(49)64)82-76-34-12-9-25-5-1-4-8-33(25)54(34)116(106,107)108;;/h1-14,17-24,83-84H,15-16,63-64H2,(H,85,86,87)(H,88,89,90)(H,91,92,93)(H,94,95,96)(H,97,98,99)(H,100,101,102)(H,103,104,105)(H,106,107,108)(H2,65,67,69,71,73)(H2,66,68,70,72,74);;

InChIKey

InChIKey=WYHFABPCENQIIN-UHFFFAOYSA-N

SMILES

OC=1C2=C(C=C(S(=O)(=O)O)C1N=NC3=C(S(=O)(=O)O)C4=C(C=C3)C=CC=C4)C=C(S(=O)(=O)O)C(N=NC5=C(S(=O)(=O)O)C=CC(NC=6N=C(NCCNC=7N=C(NC8=CC(N=NC=9C(S(=O)(=O)O)=CC%10=C(C9N)C(O)=C(N=NC%11=CC%12=C(C(S(=O)(=O)O)=C%11)C=CC=C%12)C(S(=O)(=O)O)=C%10)=C(S(=O)(=O)O)C=C8)N=C(F)N7)N=C(F)N6)=C5)=C2N.[K].[Na]

Canonical SMILES

[Na].[K].O=S(=O)(O)C1=CC=C(C=C1N=NC=2C(N)=C3C(O)=C(N=NC4=CC=5C=CC=CC5C(=C4)S(=O)(=O)O)C(=CC3=CC2S(=O)(=O)O)S(=O)(=O)O)NC6=NC(F)=NC(=N6)NCCNC=7N=C(F)N=C(N7)NC8=CC=C(C(N=NC=9C(N)=C%10C(O)=C(N=NC=%11C=CC=%12C=CC=CC%12C%11S(=O)(=O)O)C(=CC%10=CC9S(=O)(=O)O)S(=O)(=O)O)=C8)S(=O)(=O)O

Other Names for this Substance