ethyl 2-[[3,5-diacetamido-2,4,6-tris(iodanyl)phenyl]carbonylamino]-4-methyl-pentanoate

Systemtic Name: ethyl 2-[[3,5-diacetamido-2,4,6-tris(iodanyl)phenyl]carbonylamino]-4-methyl-pentanoate Openeye Name: ethyl 2-[(3,5-diacetamido-2,4,6-triiodo-benzoyl)amino]-4-methyl-pentanoate CAS Name: 2-[[(3,5-diacetamido-2,4,6-triiodophenyl)-oxomethyl]amino]-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl 2-[(3,5-diacetamido-2,4,6-triiodobenzoyl)amino]-4-methylpentanoate Traditional Name: 2-[(3,5-diacetamido-2,4,6-triiodo-benzoyl)amino]-4-methyl-valeric acid ethyl ester Formula: C19H24I3N3O5 MolecularWeight: 755.12437

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C)NC(=O)C1=C(C(=C(C(=C1I)NC(=O)C)I)NC(=O)C)I

Isomeric SMILES

CCOC(=O)C(CC(C)C)NC(=O)C1=C(C(=C(C(=C1I)NC(=O)C)I)NC(=O)C)I

InChI

InChI=1S/C19H24I3N3O5/c1-6-30-19(29)11(7-8(2)3)25-18(28)12-13(20)16(23-9(4)26)15(22)17(14(12)21)24-10(5)27/h8,11H,6-7H2,1-5H3,(H,23,26)(H,24,27)(H,25,28)