2-cyano-N-(4-hydroxyphenyl)-3-[1-(3-iodanylphenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enamide

Systemtic Name: 2-cyano-N-(4-hydroxyphenyl)-3-[1-(3-iodanylphenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enamide Openeye Name: 2-cyano-N-(4-hydroxyphenyl)-3-[1-(3-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enamide CAS Name: 2-cyano-N-(4-hydroxyphenyl)-3-[1-(3-iodophenyl)-2,5-dimethyl-3-pyrrolyl]-2-propenamide IUPAC Name: 2-cyano-N-(4-hydroxyphenyl)-3-[1-(3-iodophenyl)-2,5-dimethylpyrrol-3-yl]prop-2-enamide Traditional Name: 2-cyano-N-(4-hydroxyphenyl)-3-[1-(3-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]acrylamide Formula: C22H18IN3O2 MolecularWeight: 483.30169

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC=C2)I)C)C=C(C#N)C(=O)NC3=CC=C(C=C3)O

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC=C2)I)C)C=C(C#N)C(=O)NC3=CC=C(C=C3)O

InChI

InChI=1S/C22H18IN3O2/c1-14-10-16(15(2)26(14)20-5-3-4-18(23)12-20)11-17(13-24)22(28)25-19-6-8-21(27)9-7-19/h3-12,27H,1-2H3,(H,25,28)