RInChI=1.00.1S/C18H16BNO2/c21-19(22)15-11-13-18(14-12-15)20(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-14,21-22H!C6H4BrI/c7-5-1-3-6(8)4-2-5/h1-4H!CH2O3.2K/c2-1(3)4;;/h(H2,2,3,4);;/q;2*+1/p-2<>C24H18BrN/c25-21-15-11-19(12-16-21)20-13-17-24(18-14-20)26(22-7-3-1-4-8-22)23-9-5-2-6-10-23/h1-18H<>C4H8O2.H2O/c1-2-6-4-3-5-1;/h1-4H2;1H2/d+
RAuxInfo=1.00.1/0/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22/E:(1,2)(3,4,5,6)(7,8,9,10)(11,12)(13,14)(16,17)(21,22)/rA:22CCCCCCCCCCCCCCCCCCBNOO/rB:;d1;s1;d2;s2;s3;d4;s5;d6;;;s11;d12;d11s12;d7s8;d9s10;d13s14;s15;s16s17s18;s19;s19;/rC:;;;;;;;;;;;;;;;;;;;;;;!0/N:1,2,3,4,5,6,7,8/E:(1,2)(3,4)/rA:8CCCCCCBrI/rB:;s1;d2;d1s2;d3s4;s5;s6;/rC:;;;;;;;;!1/N:1,2,3,4;5;6/E:(2,3,4);;/rA:6COO-O-K+K+/rB:d1;s1;s1;;;/rC:;;;;;;<>0/N: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/E:(1,2)(3,4,5,6)(7,8,9,10)(11,12)(13,14)(15,16)(17,18)(22,23)/rA:26CCCCCCCCCCCCCCCCCCCCCCCCBrN/rB:;d1;s1;d2;s2;s3;d4;s5;d6;;;;;s11;d12;s13;d14;d11s12;d13s14s19;d15s16;d7s8;d9s10;d17s18;s21;s22s23s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;<>0/N:1,2,3,4,5,6;7/E:(1,2,3,4)(5,6);/rA:7CCCCOOO/rB:s1;;s3;s1s3;s2s4;;/rC:;;;;;;;
Long-RInChIKey=SA-FUHFF-TWWQCBRELPOMER-UHFFFAOYSA-N-UCCUXODGPMAHRL-UHFFFAOYSA-N-BWHMMNNQKKPAPP-UHFFFAOYSA-L--NKCKVJVKWGWKRK-UHFFFAOYSA-N--RNHDAKUGFHSZEV-UHFFFAOYSA-N
Short-RInChIKey=SA-FUHFF-GSTZQKWIAJ-NKCKVJVKWG-RNHDAKUGFH-LUHFF-NUHFF-NUHFF-ZZZ
Web-RInChIKey=ZLJVPOQTVKIMILYHW-LUHFFFADPSCTJSA