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

Systemtic Name: 2-[3,4-dimethoxy-2-[2-(3,4,5-trimethoxyphenyl)ethyl]phenyl]ethanenitrile Openeye Name: 2-[3,4-dimethoxy-2-[2-(3,4,5-trimethoxyphenyl)ethyl]phenyl]acetonitrile CAS Name: 2-[3,4-dimethoxy-2-[2-(3,4,5-trimethoxyphenyl)ethyl]phenyl]acetonitrile IUPAC Name: 2-[3,4-dimethoxy-2-[2-(3,4,5-trimethoxyphenyl)ethyl]phenyl]acetonitrile Traditional Name: 2-[3,4-dimethoxy-2-[2-(3,4,5-trimethoxyphenyl)ethyl]phenyl]acetonitrile Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO5/c1-23-17-9-7-15(10-11-22)16(20(17)26-4)8-6-14-12-18(24-2)21(27-5)19(13-14)25-3/h7,9,12-13H,6,8,10H2,1-5H3