2-[2-[2-(3,5-dimethoxyphenyl)ethyl]-3,4-dimethoxy-phenyl]ethanenitrile

Systemtic Name: 2-[2-[2-(3,5-dimethoxyphenyl)ethyl]-3,4-dimethoxy-phenyl]ethanenitrile Openeye Name: 2-[2-[2-(3,5-dimethoxyphenyl)ethyl]-3,4-dimethoxy-phenyl]acetonitrile CAS Name: 2-[2-[2-(3,5-dimethoxyphenyl)ethyl]-3,4-dimethoxyphenyl]acetonitrile IUPAC Name: 2-[2-[2-(3,5-dimethoxyphenyl)ethyl]-3,4-dimethoxyphenyl]acetonitrile Traditional Name: 2-[2-[2-(3,5-dimethoxyphenyl)ethyl]-3,4-dimethoxy-phenyl]acetonitrile Formula: C20H23NO4 MolecularWeight: 341.40092

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CC#N)CCC2=CC(=CC(=C2)OC)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CC#N)CCC2=CC(=CC(=C2)OC)OC)OC

InChI

InChI=1S/C20H23NO4/c1-22-16-11-14(12-17(13-16)23-2)5-7-18-15(9-10-21)6-8-19(24-3)20(18)25-4/h6,8,11-13H,5,7,9H2,1-4H3