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

Systemtic Name: (E)-2-benzamido-3-[3,5-bis(iodanyl)-4-propoxy-phenyl]prop-2-enoic acid Openeye Name: (E)-2-benzamido-3-(3,5-diiodo-4-propoxy-phenyl)prop-2-enoic acid CAS Name: (E)-2-benzamido-3-(3,5-diiodo-4-propoxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-benzamido-3-(3,5-diiodo-4-propoxyphenyl)prop-2-enoic acid Traditional Name: (E)-2-benzamido-3-(3,5-diiodo-4-propoxy-phenyl)acrylic acid Formula: C19H17I2NO4 MolecularWeight: 577.15152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1I)C=C(C(=O)O)NC(=O)C2=CC=CC=C2)I

Isomeric SMILES

CCCOC1=C(C=C(C=C1I)/C=C(\C(=O)O)/NC(=O)C2=CC=CC=C2)I

InChI

InChI=1S/C19H17I2NO4/c1-2-8-26-17-14(20)9-12(10-15(17)21)11-16(19(24)25)22-18(23)13-6-4-3-5-7-13/h3-7,9-11H,2,8H2,1H3,(H,22,23)(H,24,25)/b16-11+