4-[2-(hydroxymethyl)-2-methyl-butoxy]benzene-1,2-dicarbonitrile

Systemtic Name: 4-[2-(hydroxymethyl)-2-methyl-butoxy]benzene-1,2-dicarbonitrile Openeye Name: 4-[2-(hydroxymethyl)-2-methyl-butoxy]phthalonitrile CAS Name: 4-[2-(hydroxymethyl)-2-methylbutoxy]benzene-1,2-dicarbonitrile IUPAC Name: 4-[2-(hydroxymethyl)-2-methylbutoxy]benzene-1,2-dicarbonitrile Traditional Name: 4-(2-methyl-2-methylol-butoxy)phthalonitrile Formula: C14H16N2O2 MolecularWeight: 244.28904

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CO)COC1=CC(=C(C=C1)C#N)C#N

Isomeric SMILES

CCC(C)(CO)COC1=CC(=C(C=C1)C#N)C#N

InChI

InChI=1S/C14H16N2O2/c1-3-14(2,9-17)10-18-13-5-4-11(7-15)12(6-13)8-16/h4-6,17H,3,9-10H2,1-2H3