3-[[10-[[3-carboxy-2,4,6-tris(iodanyl)-5-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]amino]-10-oxidanylidene-decanoyl]amino]-2,4,6-tris(iodanyl)-5-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzoic acid

Systemtic Name: 3-[[10-[[3-carboxy-2,4,6-tris(iodanyl)-5-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]amino]-10-oxidanylidene-decanoyl]amino]-2,4,6-tris(iodanyl)-5-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzoic acid Openeye Name: 3-[[10-[3-carboxy-2,4,6-triiodo-5-[(2-oxopyrrolidin-1-yl)methyl]anilino]-10-oxo-decanoyl]amino]-2,4,6-triiodo-5-[(2-oxopyrrolidin-1-yl)methyl]benzoic acid CAS Name: 3-[[10-[3-carboxy-2,4,6-triiodo-5-[(2-oxo-1-pyrrolidinyl)methyl]anilino]-1,10-dioxodecyl]amino]-2,4,6-triiodo-5-[(2-oxo-1-pyrrolidinyl)methyl]benzoic acid IUPAC Name: 3-[[10-[3-carboxy-2,4,6-triiodo-5-[(2-oxopyrrolidin-1-yl)methyl]anilino]-10-oxodecanoyl]amino]-2,4,6-triiodo-5-[(2-oxopyrrolidin-1-yl)methyl]benzoic acid Traditional Name: 3-[[10-[3-carboxy-2,4,6-triiodo-5-[(2-ketopyrrolidino)methyl]anilino]-10-keto-decanoyl]amino]-2,4,6-triiodo-5-[(2-ketopyrrolidino)methyl]benzoic acid Formula: C34H36I6N4O8 MolecularWeight: 1390.09846

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC2=C(C(=C(C(=C2I)C(=O)O)I)NC(=O)CCCCCCCCC(=O)NC3=C(C(=C(C(=C3I)CN4CCCC4=O)I)C(=O)O)I)I

Isomeric SMILES

C1CC(=O)N(C1)CC2=C(C(=C(C(=C2I)C(=O)O)I)NC(=O)CCCCCCCCC(=O)NC3=C(C(=C(C(=C3I)CN4CCCC4=O)I)C(=O)O)I)I

InChI

InChI=1S/C34H36I6N4O8/c35-25-17(15-43-13-7-11-21(43)47)27(37)31(29(39)23(25)33(49)50)41-19(45)9-5-3-1-2-4-6-10-20(46)42-32-28(38)18(16-44-14-8-12-22(44)48)26(36)24(30(32)40)34(51)52/h1-16H2,(H,41,45)(H,42,46)(H,49,50)(H,51,52)