2-[3-[ethanoyl(methyl)amino]-2,4,6-tris(iodanyl)phenoxy]-2-(4-methylphenyl)ethanoic acid

Systemtic Name: 2-[3-[ethanoyl(methyl)amino]-2,4,6-tris(iodanyl)phenoxy]-2-(4-methylphenyl)ethanoic acid Openeye Name: 2-[3-[acetyl(methyl)amino]-2,4,6-triiodo-phenoxy]-2-(p-tolyl)acetic acid CAS Name: 2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenoxy]-2-(4-methylphenyl)acetic acid IUPAC Name: 2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenoxy]-2-(4-methylphenyl)acetic acid Traditional Name: 2-[3-[acetyl(methyl)amino]-2,4,6-triiodo-phenoxy]-2-(p-tolyl)acetic acid Formula: C18H16I3NO4 MolecularWeight: 691.03735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(=O)O)OC2=C(C=C(C(=C2I)N(C)C(=O)C)I)I

Isomeric SMILES

CC1=CC=C(C=C1)C(C(=O)O)OC2=C(C=C(C(=C2I)N(C)C(=O)C)I)I

InChI

InChI=1S/C18H16I3NO4/c1-9-4-6-11(7-5-9)16(18(24)25)26-17-13(20)8-12(19)15(14(17)21)22(3)10(2)23/h4-8,16H,1-3H3,(H,24,25)