4,4'-Dichloroindigo

Properties Image MNX_ID MNXM166285 reference sabiorkM:24996 formula C16H8Cl2N2O2 global charge 0 mol weight 331.158 InChIKey ARRVPHBRLHNLMH-YPKPFQOOSA-N InChI InChI=1S/C16H8Cl2N2O2/c17-7-3-1-5-9-11(7)15(21)13(19-9)14-16(22)12-8(18)4-2-6-10(12)20-14/h1-6,19-20H/b14-13- SMILES O=C1C2=C(Cl)C=CC=C2N/C1=C1\NC2=CC=CC(Cl)=C2C1=O MNX internals InChI (mnx) InChI=1/C16H8Cl2N2O2/c17-7-3-1-5-9-11(7)15(21)13(19-9)14-16(22)12-8(18)4-2-6-10(12)20-14/h1-6,19-20H/b14-13- SMILES (mnx) [CH:1]1=[CH:3][C:7]([Cl:17])=[C:11]2[C:9](=[CH:5]1)[NH:19]/[C:13](=[C:14]1/[C:16](=[O:22])[C:12]3=[C:8]([Cl:18])[CH:4]=[CH:2][CH:6]=[C:10]3[NH:20]1)[C:15]2=[O:21]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0