2-(2,2-dimethoxyethyl)-2-(4-iodophenyl)-4,4-dimethoxy-butanenitrile

Systemtic Name: 2-(2,2-dimethoxyethyl)-2-(4-iodophenyl)-4,4-dimethoxy-butanenitrile Openeye Name: 2-(2,2-dimethoxyethyl)-2-(4-iodophenyl)-4,4-dimethoxy-butanenitrile CAS Name: 2-(2,2-dimethoxyethyl)-2-(4-iodophenyl)-4,4-dimethoxybutanenitrile IUPAC Name: 2-(2,2-dimethoxyethyl)-2-(4-iodophenyl)-4,4-dimethoxybutanenitrile Traditional Name: 2-(2,2-dimethoxyethyl)-2-(4-iodophenyl)-4,4-dimethoxy-butyronitrile Formula: C16H22INO4 MolecularWeight: 419.25465

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC(CC(OC)OC)(C#N)C1=CC=C(C=C1)I)OC

Isomeric SMILES

COC(CC(CC(OC)OC)(C#N)C1=CC=C(C=C1)I)OC

InChI

InChI=1S/C16H22INO4/c1-19-14(20-2)9-16(11-18,10-15(21-3)22-4)12-5-7-13(17)8-6-12/h5-8,14-15H,9-10H2,1-4H3