2-[phenyl-[(3,4,5-trimethoxyphenyl)methyl]amino]ethanenitrile

Systemtic Name: 2-[phenyl-[(3,4,5-trimethoxyphenyl)methyl]amino]ethanenitrile Openeye Name: 2-[N-[(3,4,5-trimethoxyphenyl)methyl]anilino]acetonitrile CAS Name: 2-[N-[(3,4,5-trimethoxyphenyl)methyl]anilino]acetonitrile IUPAC Name: 2-[N-[(3,4,5-trimethoxyphenyl)methyl]anilino]acetonitrile Traditional Name: 2-(N-(3,4,5-trimethoxybenzyl)anilino)acetonitrile Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CN(CC#N)C2=CC=CC=C2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CN(CC#N)C2=CC=CC=C2

InChI

InChI=1S/C18H20N2O3/c1-21-16-11-14(12-17(22-2)18(16)23-3)13-20(10-9-19)15-7-5-4-6-8-15/h4-8,11-12H,10,13H2,1-3H3