(E)-2-acetamido-3-[3,5-bis(iodanyl)-4-prop-2-enoxy-phenyl]prop-2-enoic acid

Systemtic Name: (E)-2-acetamido-3-[3,5-bis(iodanyl)-4-prop-2-enoxy-phenyl]prop-2-enoic acid Openeye Name: (E)-2-acetamido-3-(4-allyloxy-3,5-diiodo-phenyl)prop-2-enoic acid CAS Name: (E)-2-acetamido-3-(3,5-diiodo-4-prop-2-enoxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-acetamido-3-(3,5-diiodo-4-prop-2-enoxyphenyl)prop-2-enoic acid Traditional Name: (E)-2-acetamido-3-(4-allyloxy-3,5-diiodo-phenyl)acrylic acid Formula: C14H13I2NO4 MolecularWeight: 513.06626

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=CC1=CC(=C(C(=C1)I)OCC=C)I)C(=O)O

Isomeric SMILES

CC(=O)N/C(=C/C1=CC(=C(C(=C1)I)OCC=C)I)/C(=O)O

InChI

InChI=1S/C14H13I2NO4/c1-3-4-21-13-10(15)5-9(6-11(13)16)7-12(14(19)20)17-8(2)18/h3,5-7H,1,4H2,2H3,(H,17,18)(H,19,20)/b12-7+