26 27 0 0000 0 0 0 0 0999 V2000 3.3175 -12.6622 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 3.9886 -11.5099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.3181 -11.5099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 3.3175 -10.3576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.9886 -9.2054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.3175 -8.0531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.9886 -6.9009 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 3.3175 -5.7613 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 3.9886 -4.6090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.3181 -4.6090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.9765 -3.4568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.3181 -2.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.9886 -2.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.3175 -3.4568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.3175 -1.1523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.9886 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 1.9880 -1.1523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 5.9765 -1.1523 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 7.3061 -1.1523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 5.3181 0.0000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 1.9880 -8.0531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.3295 -9.2054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.9880 -10.3576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.3295 -11.5099 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0.0000 -11.5099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 1.9880 -12.6622 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 4 23 2 0 5 6 2 0 6 7 1 0 6 21 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 14 2 0 10 11 2 0 11 12 1 0 12 13 2 0 12 18 1 0 13 14 1 0 13 15 1 0 15 16 2 0 15 17 1 0 18 19 2 0 18 20 1 0 21 22 2 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 M CHG 4 18 1 20 -1 24 1 26 -1 M END > InChI=1S/C14H8N2O8S2/c17-13(18)9-5-7(1-3-11(9)15(21)22)25-26-8-2-4-12(16(23)24)10(6-8)14(19)20/h1-6H,(H,17,18)(H,19,20) > KIUMMUBSPKGMOY-UHFFFAOYSA-N > 1/1/N:10,21,11,22,14,5,9,6,13,4,12,23,15,2,18,24,16,17,1,3,19,20,25,26,8,7/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)(15,16)(17,18,19,20)(21,22,23,24)(25,26)/gE:(1,2)/CRV:15.5,16.5/rA:26nOCOCCCSSCCCCCCCOON+OO-CCCN+OO-/rB:s1;d2;s2;s4;d5;s6;s7;s8;s9;d10;s11;d12;d9s13;s13;d15;s15;s12;d18;s18;s6;d21;d4s22;s23;d24;s24;/rC:3.3175,-12.6622,0;3.9886,-11.5099,0;5.3181,-11.5099,0;3.3175,-10.3576,0;3.9886,-9.2054,0;3.3175,-8.0531,0;3.9886,-6.9009,0;3.3175,-5.7613,0;3.9886,-4.609,0;5.3181,-4.609,0;5.9765,-3.4568,0;5.3181,-2.3045,0;3.9886,-2.3045,0;3.3175,-3.4568,0;3.3175,-1.1523,0;3.9886,0,0;1.988,-1.1523,0;5.9765,-1.1523,0;7.3061,-1.1523,0;5.3181,0,0;1.988,-8.0531,0;1.3295,-9.2054,0;1.988,-10.3576,0;1.3295,-11.5099,0;0,-11.5099,0;1.988,-12.6622,0; > C14 H8 N2 O8 S2 > 396.3519 > OC(C1=C([N+]([O-])=O)C=CC(SSC2=CC(C(O)=O)=C([N+]([O-])=O)C=C2)=C1)=O > 6018 $$$$