ethyl (E)-2-cyano-3-[3-iodanyl-5-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[3-iodanyl-5-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[3-iodo-5-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[3-iodo-5-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[3-iodo-5-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[3-iodo-5-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl]acrylic acid ethyl ester Formula: C22H22INO5 MolecularWeight: 507.31825

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=C(C(=C1)I)OCCOC2=CC=CC=C2C)OC)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC(=C(C(=C1)I)OCCOC2=CC=CC=C2C)OC)/C#N

InChI

InChI=1S/C22H22INO5/c1-4-27-22(25)17(14-24)11-16-12-18(23)21(20(13-16)26-3)29-10-9-28-19-8-6-5-7-15(19)2/h5-8,11-13H,4,9-10H2,1-3H3/b17-11+