3-(butanoylamino)-2,4,6-triiodo-5-(methylcarbamoyl)benzoate; methyl-(2,3,4,5,6-pentahydroxyhexyl)azanium

Molecular Formula: C20H30I3N3O9


InChI: InChI=1/C13H13I3N2O4.C7H17NO5/c1-3-4-5(19)18-11-9(15)6(12(20)17-2)8(14)7(10(11)16)13(21)22;1-8-2-4(10)6(12)7(13)5(11)3-9/h3-4H2,1-2H3,(H,17,20)(H,18,19)(H,21,22);4-13H,2-3H2,1H3/fC13H12I3N2O4.C7H18NO5/h17-18H;8H/q-1;+1

InChIKey: InChIKey=XECUYVLMRPJEFX-GNGZRDHACE
SMILES: CCCC(=O)NC1=C(C(=C(C(=C1I)C(=O)[O-])I)C(=O)NC)I.C[NH2+]CC(C(C(C(CO)O)O)O)O

Names:
    Isophthalamic acid, 5-butyrylamino-N-methyl-2,4,6-triiodo-, N-methylglucamine salt
    ISOPHTHALAMIC ACID, 5-BUTYRYLAMINO-N-METHYL-2,4,6-TRIIODO-, N-METHYLGLUCAMINE SA
    3-(butanoylamino)-2,4,6-triiodo-5-(methylcarbamoyl)benzoate; methyl-(2,3,4,5,6-pentahydroxyhexyl)azanium
    5-Butyrylamino-N-methyl-2,4,6-triiodoisophthalamic acid N-methylglucamine salt
    67336-59-8

Registries:
    PubChem CID 49806
    PubChem ID 188401