2-azanyl-2-[(3,4-dimethoxyphenyl)methyl]-3,3-bis(fluoranyl)propanenitrile

Systemtic Name: 2-azanyl-2-[(3,4-dimethoxyphenyl)methyl]-3,3-bis(fluoranyl)propanenitrile Openeye Name: 2-amino-2-[(3,4-dimethoxyphenyl)methyl]-3,3-difluoro-propanenitrile CAS Name: 2-amino-2-[(3,4-dimethoxyphenyl)methyl]-3,3-difluoropropanenitrile IUPAC Name: 2-amino-2-[(3,4-dimethoxyphenyl)methyl]-3,3-difluoropropanenitrile Traditional Name: 2-amino-3,3-difluoro-2-veratryl-propionitrile Formula: C12H14F2N2O2 MolecularWeight: 256.248566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14F2N2O2/c1-17-9-4-3-8(5-10(9)18-2)6-12(16,7-15)11(13)14/h3-5,11H,6,16H2,1-2H3