3,3-bis(3,4-dimethoxyphenyl)propanenitrile

Systemtic Name: 3,3-bis(3,4-dimethoxyphenyl)propanenitrile Openeye Name: 3,3-bis(3,4-dimethoxyphenyl)propanenitrile CAS Name: 3,3-bis(3,4-dimethoxyphenyl)propanenitrile IUPAC Name: 3,3-bis(3,4-dimethoxyphenyl)propanenitrile Traditional Name: 3,3-bis(3,4-dimethoxyphenyl)propionitrile Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO4/c1-21-16-7-5-13(11-18(16)23-3)15(9-10-20)14-6-8-17(22-2)19(12-14)24-4/h5-8,11-12,15H,9H2,1-4H3