3-[(3,5-dimethoxyphenyl)methyl]pentanedinitrile

Systemtic Name: 3-[(3,5-dimethoxyphenyl)methyl]pentanedinitrile Openeye Name: 3-[(3,5-dimethoxyphenyl)methyl]pentanedinitrile CAS Name: 3-[(3,5-dimethoxyphenyl)methyl]pentanedinitrile IUPAC Name: 3-[(3,5-dimethoxyphenyl)methyl]pentanedinitrile Traditional Name: 3-(3,5-dimethoxybenzyl)glutaronitrile Formula: C14H16N2O2 MolecularWeight: 244.28904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CC(CC#N)CC#N)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CC(CC#N)CC#N)OC

InChI

InChI=1S/C14H16N2O2/c1-17-13-8-12(9-14(10-13)18-2)7-11(3-5-15)4-6-16/h8-11H,3-4,7H2,1-2H3