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

Systemtic Name: (E)-2-benzamido-3-[3,5-bis(iodanyl)-4-phenylmethoxy-phenyl]prop-2-enoic acid Openeye Name: (E)-2-benzamido-3-(4-benzyloxy-3,5-diiodo-phenyl)prop-2-enoic acid CAS Name: (E)-2-benzamido-3-(3,5-diiodo-4-phenylmethoxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-benzamido-3-(3,5-diiodo-4-phenylmethoxyphenyl)prop-2-enoic acid Traditional Name: (E)-2-benzamido-3-(4-benzoxy-3,5-diiodo-phenyl)acrylic acid Formula: C23H17I2NO4 MolecularWeight: 625.19432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2I)C=C(C(=O)O)NC(=O)C3=CC=CC=C3)I

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2I)/C=C(\C(=O)O)/NC(=O)C3=CC=CC=C3)I

InChI

InChI=1S/C23H17I2NO4/c24-18-11-16(12-19(25)21(18)30-14-15-7-3-1-4-8-15)13-20(23(28)29)26-22(27)17-9-5-2-6-10-17/h1-13H,14H2,(H,26,27)(H,28,29)/b20-13+