2-[3-[2-(cyanomethyl)-4,5-dimethoxy-phenoxy]-4-oxidanyl-phenyl]ethanenitrile

Systemtic Name: 2-[3-[2-(cyanomethyl)-4,5-dimethoxy-phenoxy]-4-oxidanyl-phenyl]ethanenitrile Openeye Name: 2-[3-[2-(cyanomethyl)-4,5-dimethoxy-phenoxy]-4-hydroxy-phenyl]acetonitrile CAS Name: 2-[3-[2-(cyanomethyl)-4,5-dimethoxyphenoxy]-4-hydroxyphenyl]acetonitrile IUPAC Name: 2-[3-[2-(cyanomethyl)-4,5-dimethoxyphenoxy]-4-hydroxyphenyl]acetonitrile Traditional Name: 2-[3-[2-(cyanomethyl)-4,5-dimethoxy-phenoxy]-4-hydroxy-phenyl]acetonitrile Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CC#N)OC2=C(C=CC(=C2)CC#N)O)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CC#N)OC2=C(C=CC(=C2)CC#N)O)OC

InChI

InChI=1S/C18H16N2O4/c1-22-17-10-13(6-8-20)15(11-18(17)23-2)24-16-9-12(5-7-19)3-4-14(16)21/h3-4,9-11,21H,5-6H2,1-2H3