(E)-2-cyano-N-(2-ethylphenyl)-3-[3-[(4-iodanylphenoxy)methyl]-4-methoxy-phenyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(2-ethylphenyl)-3-[3-[(4-iodanylphenoxy)methyl]-4-methoxy-phenyl]prop-2-enamide Openeye Name: (E)-2-cyano-N-(2-ethylphenyl)-3-[3-[(4-iodophenoxy)methyl]-4-methoxy-phenyl]prop-2-enamide CAS Name: (E)-2-cyano-N-(2-ethylphenyl)-3-[3-[(4-iodophenoxy)methyl]-4-methoxyphenyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(2-ethylphenyl)-3-[3-[(4-iodophenoxy)methyl]-4-methoxyphenyl]prop-2-enamide Traditional Name: (E)-2-cyano-N-(2-ethylphenyl)-3-[3-[(4-iodophenoxy)methyl]-4-methoxy-phenyl]acrylamide Formula: C26H23IN2O3 MolecularWeight: 538.37689

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C(=CC2=CC(=C(C=C2)OC)COC3=CC=C(C=C3)I)C#N

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)/C(=C/C2=CC(=C(C=C2)OC)COC3=CC=C(C=C3)I)/C#N

InChI

InChI=1S/C26H23IN2O3/c1-3-19-6-4-5-7-24(19)29-26(30)20(16-28)14-18-8-13-25(31-2)21(15-18)17-32-23-11-9-22(27)10-12-23/h4-15H,3,17H2,1-2H3,(H,29,30)/b20-14+