4-[2-(4-iodophenyl)-2-oxidanylidene-ethoxy]-3-methoxy-benzenecarbonitrile

Systemtic Name: 4-[2-(4-iodophenyl)-2-oxidanylidene-ethoxy]-3-methoxy-benzenecarbonitrile Openeye Name: 4-[2-(4-iodophenyl)-2-oxo-ethoxy]-3-methoxy-benzonitrile CAS Name: 4-[2-(4-iodophenyl)-2-oxoethoxy]-3-methoxybenzonitrile IUPAC Name: 4-[2-(4-iodophenyl)-2-oxoethoxy]-3-methoxybenzonitrile Traditional Name: 4-[2-(4-iodophenyl)-2-keto-ethoxy]-3-methoxy-benzonitrile Formula: C16H12INO3 MolecularWeight: 393.17585

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12INO3/c1-20-16-8-11(9-18)2-7-15(16)21-10-14(19)12-3-5-13(17)6-4-12/h2-8H,10H2,1H3