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

Systemtic Name: (E)-3-[4-acetyloxy-3,5-bis(iodanyl)phenyl]-2-benzamido-prop-2-enoic acid Openeye Name: (E)-3-(4-acetoxy-3,5-diiodo-phenyl)-2-benzamido-prop-2-enoic acid CAS Name: (E)-3-(4-acetyloxy-3,5-diiodophenyl)-2-benzamido-2-propenoic acid IUPAC Name: (E)-3-(4-acetyloxy-3,5-diiodophenyl)-2-benzamidoprop-2-enoic acid Traditional Name: (E)-3-(4-acetoxy-3,5-diiodo-phenyl)-2-benzamido-acrylic acid Formula: C18H13I2NO5 MolecularWeight: 577.10846

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1I)C=C(C(=O)O)NC(=O)C2=CC=CC=C2)I

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1I)/C=C(\C(=O)O)/NC(=O)C2=CC=CC=C2)I

InChI

InChI=1S/C18H13I2NO5/c1-10(22)26-16-13(19)7-11(8-14(16)20)9-15(18(24)25)21-17(23)12-5-3-2-4-6-12/h2-9H,1H3,(H,21,23)(H,24,25)/b15-9+