RInChI=1.00.1S/C10H12ClN3O3/c11-10-12-8(14-1-3-15-4-2-14)7-9(13-10)17-6-5-16-7/h1-6H2!C10H16BN3O2/c1-9(2)10(3,4)16-11(15-9)7-5-13-8(12)14-6-7/h5-6H,1-4H3,(H2,12,13,14)!CH2Cl2/c2-1-3/h1H2!CH2O3.2Cs/c2-1(3)4;;/h(H2,2,3,4);;/q;2*+1/p-2<>C14H16N6O3/c15-14-16-7-9(8-17-14)11-18-12(20-1-3-21-4-2-20)10-13(19-11)23-6-5-22-10/h7-8H,1-6H2,(H2,15,16,17)<>C4H8O2/c1-2-6-4-3-5-1/h1-4H2!H2O/h1H2/d+
RAuxInfo=1.00.1/0/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17/E:(1,2)(3,4)/rA:17CCCCCCCCCCClNNNOOO/rB:;s1;s2;;s5;;d7;s7;;s10;s8d10;d9s10;s1s2s8;s3s4;s5s7;s6s9;/rC:;;;;;;;;;;;;;;;;;!1/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16/E:(1,2,3,4)(5,6)(9,10)(13,14)(15,16)/rA:16CCCCCCCCCCBNNNOO/rB:;;;;;d5s6;;s1s2;s3s4s9;s7;d8;s5s8;d6s8;s9s11;s10s11;/rC:;;;;;;;;;;;;;;;;!0/N:1,2,3/E:(2,3)/rA:3CClCl/rB:s1;s1;/rC:;;;!1/N:1,2,3,4;5;6/E:(2,3,4);;/rA:6COO-O-Cs+Cs+/rB:d1;s1;s1;;;/rC:;;;;;;<>1/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23/E:(1,2)(3,4)(7,8)(16,17)/rA:23CCCCCCCCCCCCCCNNNNNNOOO/rB:;s1;s2;;s5;;;d7s8;;s9;d10;s10;;d14;s7s14;d8s14;d11s12;s11d13;s1s2s12;s3s4;s5s10;s6s13;/rC:;;;;;;;;;;;;;;;;;;;;;;;<>0/N:1,2,3,4,5,6/E:(1,2,3,4)(5,6)/rA:6CCCCOO/rB:s1;;s3;s1s3;s2s4;/rC:;;;;;;!0/N:1/rA:1O/rB:/rC:;
Long-RInChIKey=SA-FUHFF-JRTLCOIQJLBQCE-UHFFFAOYSA-N-BPQVMIDUTRJYSC-UHFFFAOYSA-N-YMWUJEATGCHHMB-UHFFFAOYSA-N-FJDQFPXHSGXQBY-UHFFFAOYSA-L--WQKUNLBQORVRGR-UHFFFAOYSA-N--RYHBNJHYFVUHQT-UHFFFAOYSA-N-XLYOFNOQVPJJNP-UHFFFAOYSA-N
Short-RInChIKey=SA-FUHFF-PXCJTGNAIP-WQKUNLBQOR-IEVYJNIMII-LUHFF-NUHFF-NUHFF-ZZZ
Web-RInChIKey=MAQISGHMROUSEZADU-LUHFFFADPSCTJSA