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

Systemtic Name: 2-azanyl-2-[(3,4-dimethoxyphenyl)methyl]-3-fluoranyl-propanenitrile Openeye Name: 2-amino-2-[(3,4-dimethoxyphenyl)methyl]-3-fluoro-propanenitrile CAS Name: 2-amino-2-[(3,4-dimethoxyphenyl)methyl]-3-fluoropropanenitrile IUPAC Name: 2-amino-2-[(3,4-dimethoxyphenyl)methyl]-3-fluoropropanenitrile Traditional Name: 2-amino-3-(3,4-dimethoxyphenyl)-2-(fluoromethyl)propionitrile Formula: C12H15FN2O2 MolecularWeight: 238.258103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15FN2O2/c1-16-10-4-3-9(5-11(10)17-2)6-12(15,7-13)8-14/h3-5H,6-7,15H2,1-2H3