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

Systemtic Name: 3-[[10-[[3-carboxy-2,4,6-tris(iodanyl)-5-(propylcarbamoyl)phenyl]amino]-10-oxidanylidene-decanoyl]amino]-2,4,6-tris(iodanyl)-5-(propylcarbamoyl)benzoic acid Openeye Name: 3-[[10-[3-carboxy-2,4,6-triiodo-5-(propylcarbamoyl)anilino]-10-oxo-decanoyl]amino]-2,4,6-triiodo-5-(propylcarbamoyl)benzoic acid CAS Name: 3-[[10-[3-carboxy-2,4,6-triiodo-5-[oxo(propylamino)methyl]anilino]-1,10-dioxodecyl]amino]-2,4,6-triiodo-5-[oxo(propylamino)methyl]benzoic acid IUPAC Name: 3-[[10-[3-carboxy-2,4,6-triiodo-5-(propylcarbamoyl)anilino]-10-oxodecanoyl]amino]-2,4,6-triiodo-5-(propylcarbamoyl)benzoic acid Traditional Name: 3-[[10-[3-carboxy-2,4,6-triiodo-5-(propylcarbamoyl)anilino]-10-keto-decanoyl]amino]-2,4,6-triiodo-5-(propylcarbamoyl)benzoic acid Formula: C32H36I6N4O8 MolecularWeight: 1366.07706

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=C(C(=C(C(=C1I)NC(=O)CCCCCCCCC(=O)NC2=C(C(=C(C(=C2I)C(=O)O)I)C(=O)NCCC)I)I)C(=O)O)I

Isomeric SMILES

CCCNC(=O)C1=C(C(=C(C(=C1I)NC(=O)CCCCCCCCC(=O)NC2=C(C(=C(C(=C2I)C(=O)O)I)C(=O)NCCC)I)I)C(=O)O)I

InChI

InChI=1S/C32H36I6N4O8/c1-3-13-39-29(45)17-21(33)19(31(47)48)25(37)27(23(17)35)41-15(43)11-9-7-5-6-8-10-12-16(44)42-28-24(36)18(30(46)40-14-4-2)22(34)20(26(28)38)32(49)50/h3-14H2,1-2H3,(H,39,45)(H,40,46)(H,41,43)(H,42,44)(H,47,48)(H,49,50)