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

Systemtic Name: ethyl (E)-2-cyano-3-[4-[(2-cyanophenyl)methoxy]-3-iodanyl-5-methoxy-phenyl]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[4-[(2-cyanophenyl)methoxy]-3-iodo-5-methoxy-phenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[4-[(2-cyanophenyl)methoxy]-3-iodo-5-methoxyphenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[4-[(2-cyanophenyl)methoxy]-3-iodo-5-methoxyphenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[4-(2-cyanobenzyl)oxy-3-iodo-5-methoxy-phenyl]acrylic acid ethyl ester Formula: C21H17IN2O4 MolecularWeight: 488.27515

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=C(C(=C1)I)OCC2=CC=CC=C2C#N)OC)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC(=C(C(=C1)I)OCC2=CC=CC=C2C#N)OC)/C#N

InChI

InChI=1S/C21H17IN2O4/c1-3-27-21(25)17(12-24)8-14-9-18(22)20(19(10-14)26-2)28-13-16-7-5-4-6-15(16)11-23/h4-10H,3,13H2,1-2H3/b17-8+