N,N'-bis(1-pentylquinolin-6-yl)benzene-1,4-dicarboxamide; 4-methylbenzenesulfonate

Molecular Formula: C50H54N4O8S2


InChI: InChI=1/C36H38N4O2.2C7H8O3S/c1-3-5-7-21-39-23-9-11-29-25-31(17-19-33(29)39)37-35(41)27-13-15-28(16-14-27)36(42)38-32-18-20-34-30(26-32)12-10-24-40(34)22-8-6-4-2;2*1-6-2-4-7(5-3-6)11(8,9)10/h9-20,23-26H,3-8,21-22H2,1-2H3;2*2-5H,1H3,(H,8,9,10)/fC36H40N4O2.2C7H7O3S/h37-38H;;/q+2;2*-1

InChIKey: InChIKey=MXEZIDLDFCAJBZ-HEHJDKKXCX
SMILES: CCCCC[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC5=C(C=C4)[N+](=CC=C5)CCCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]

Names:
    N,N'-bis(1-pentylquinolin-6-yl)benzene-1,4-dicarboxamide; 4-methylbenzenesulfonate

Registries:
    PubChem CID 205712
    PubChem ID 10266903