5-(2-azanylethanoylamino)-N3-[2-(2-hydroxyethyloxy)ethyl]-2,4,6-tris(iodanyl)benzene-1,3-dicarboxamide

Systemtic Name: 5-(2-azanylethanoylamino)-N3-[2-(2-hydroxyethyloxy)ethyl]-2,4,6-tris(iodanyl)benzene-1,3-dicarboxamide Openeye Name: 5-[(2-aminoacetyl)amino]-N3-[2-(2-hydroxyethoxy)ethyl]-2,4,6-triiodo-benzene-1,3-dicarboxamide CAS Name: 5-[(2-amino-1-oxoethyl)amino]-N3-[2-(2-hydroxyethoxy)ethyl]-2,4,6-triiodobenzene-1,3-dicarboxamide IUPAC Name: 5-[(2-aminoacetyl)amino]-3-N-[2-(2-hydroxyethoxy)ethyl]-2,4,6-triiodobenzene-1,3-dicarboxamide Traditional Name: 5-(glycylamino)-N'-[2-(2-hydroxyethoxy)ethyl]-2,4,6-triiodo-isophthalamide Formula: C14H17I3N4O5 MolecularWeight: 702.02199

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Descriptors Computed from Structure

Canonical SMILES:

C(COCCO)NC(=O)C1=C(C(=C(C(=C1I)C(=O)N)I)NC(=O)CN)I

Isomeric SMILES

C(COCCO)NC(=O)C1=C(C(=C(C(=C1I)C(=O)N)I)NC(=O)CN)I

InChI

InChI=1S/C14H17I3N4O5/c15-9-7(13(19)24)10(16)12(21-6(23)5-18)11(17)8(9)14(25)20-1-3-26-4-2-22/h22H,1-5,18H2,(H2,19,24)(H,20,25)(H,21,23)