4,4-dimethoxy-2-[(3-methylphenyl)-oxidanyl-methyl]butanenitrile

Systemtic Name: 4,4-dimethoxy-2-[(3-methylphenyl)-oxidanyl-methyl]butanenitrile Openeye Name: 2-[hydroxy(m-tolyl)methyl]-4,4-dimethoxy-butanenitrile CAS Name: 2-[hydroxy-(3-methylphenyl)methyl]-4,4-dimethoxybutanenitrile IUPAC Name: 2-[hydroxy-(3-methylphenyl)methyl]-4,4-dimethoxybutanenitrile Traditional Name: 2-[hydroxy(m-tolyl)methyl]-4,4-dimethoxy-butyronitrile Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C(CC(OC)OC)C#N)O

Isomeric SMILES

CC1=CC(=CC=C1)C(C(CC(OC)OC)C#N)O

InChI

InChI=1S/C14H19NO3/c1-10-5-4-6-11(7-10)14(16)12(9-15)8-13(17-2)18-3/h4-7,12-14,16H,8H2,1-3H3