2-[4-[(E)-3-(4-iodophenyl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(E)-3-(4-iodophenyl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]ethanenitrile Openeye Name: 2-[4-[(E)-3-(4-iodophenyl)-3-oxo-prop-1-enyl]-2-methoxy-phenoxy]acetonitrile CAS Name: 2-[4-[(E)-3-(4-iodophenyl)-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetonitrile IUPAC Name: 2-[4-[(E)-3-(4-iodophenyl)-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetonitrile Traditional Name: 2-[4-[(E)-3-(4-iodophenyl)-3-keto-prop-1-enyl]-2-methoxy-phenoxy]acetonitrile Formula: C18H14INO3 MolecularWeight: 419.21313

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)C2=CC=C(C=C2)I)OCC#N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)C2=CC=C(C=C2)I)OCC#N

InChI

InChI=1S/C18H14INO3/c1-22-18-12-13(3-9-17(18)23-11-10-20)2-8-16(21)14-4-6-15(19)7-5-14/h2-9,12H,11H2,1H3/b8-2+