(E)-3-(3-iodanyl-5-methoxy-4-oxidanyl-phenyl)-2-(2-methylfuran-3-yl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3-iodanyl-5-methoxy-4-oxidanyl-phenyl)-2-(2-methylfuran-3-yl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(4-hydroxy-3-iodo-5-methoxy-phenyl)-2-(2-methylfuran-3-carbonyl)prop-2-enenitrile CAS Name: (E)-3-(4-hydroxy-3-iodo-5-methoxyphenyl)-2-[(2-methyl-3-furanyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(4-hydroxy-3-iodo-5-methoxyphenyl)-2-(2-methylfuran-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(4-hydroxy-3-iodo-5-methoxy-phenyl)-2-(2-methyl-3-furoyl)acrylonitrile Formula: C16H12INO4 MolecularWeight: 409.17525

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)C(=CC2=CC(=C(C(=C2)I)O)OC)C#N

Isomeric SMILES

CC1=C(C=CO1)C(=O)/C(=C/C2=CC(=C(C(=C2)I)O)OC)/C#N

InChI

InChI=1S/C16H12INO4/c1-9-12(3-4-22-9)15(19)11(8-18)5-10-6-13(17)16(20)14(7-10)21-2/h3-7,20H,1-2H3/b11-5+