Canonical SMILES CCCCCC(C)CC(C)C=C(C)C(=O)C(C)C(=O)CC
InChI InChI=1/C20H36O2/c1-8-10-14(3)11-15(4)12-16(5)13-17(6)20(22)18(7)19(21)9-2/h13-16,18H,8-12H2,1-7H3/b17-13+/t14-,15-,16-,18+/m0/s1 AuxInfo=1/0/N:14,21,15,16,17,19,22,1,13,2,4,6,8,3,5,7,9,11,12,10,20,18/it:im/rA:22nCCCCCCCCCCCCCCCCCOCOCC/rB:s1;s2;s3;s4;s5;s6;s7;d8;s9;s10;s11;s12;s1;N3;N5;N7;d10;s9;d12;s13;N11;/rC:-4.2868,.2062,0;-3.5724,-.2062,0;-2.8579,.2062,0;-2.1434,-.2062,0;-1.4289,.2062,0;-.7145,-.2062,0;0,.2062,0;.7145,-.2062,0;1.4289,.2062,0;2.1434,-.2062,0;2.8579,.2062,0;3.5724,-.2062,0;4.2868,.2062,0;-4.2868,1.0312,0;-2.8579,1.0312,0;-1.4289,1.0312,0;0,1.0312,0;2.1434,-1.0312,0;1.4289,1.0312,0;3.5724,-1.0312,0;4.2868,1.0312,0;2.8579,1.0312,0;
MInChI v0.9 MInChIxe1 C20H36O2 c1xh8xh10xh1 4xl3xr11xh15 xl4xr12xh16x l5xr13xh17xl 6xr20xl22xr1 8xl7xr19xl21 xr9xh2xsh13x h16xc18Hxc8x h12H2xc1xh7H 3xsb17xh13xp xst14xhxc15x hxc16xhxc18x pxsm0xss1
