2,2-bis(3,4-dimethoxyphenyl)ethanenitrile

Systemtic Name: 2,2-bis(3,4-dimethoxyphenyl)ethanenitrile Openeye Name: 2,2-bis(3,4-dimethoxyphenyl)acetonitrile CAS Name: 2,2-bis(3,4-dimethoxyphenyl)acetonitrile IUPAC Name: 2,2-bis(3,4-dimethoxyphenyl)acetonitrile Traditional Name: 2,2-bis(3,4-dimethoxyphenyl)acetonitrile Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19NO4/c1-20-15-7-5-12(9-17(15)22-3)14(11-19)13-6-8-16(21-2)18(10-13)23-4/h5-10,14H,1-4H3