3-[[1-[2-(3,4-dimethoxyphenyl)ethyl]benzimidazol-2-yl]-methyl-amino]propanenitrile

Systemtic Name: 3-[[1-[2-(3,4-dimethoxyphenyl)ethyl]benzimidazol-2-yl]-methyl-amino]propanenitrile Openeye Name: 3-[[1-[2-(3,4-dimethoxyphenyl)ethyl]benzimidazol-2-yl]-methyl-amino]propanenitrile CAS Name: 3-[[1-[2-(3,4-dimethoxyphenyl)ethyl]-2-benzimidazolyl]-methylamino]propanenitrile IUPAC Name: 3-[[1-[2-(3,4-dimethoxyphenyl)ethyl]benzimidazol-2-yl]-methylamino]propanenitrile Traditional Name: 3-[(1-homoveratrylbenzimidazol-2-yl)-methyl-amino]propionitrile Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C1=NC2=CC=CC=C2N1CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN(CCC#N)C1=NC2=CC=CC=C2N1CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H24N4O2/c1-24(13-6-12-22)21-23-17-7-4-5-8-18(17)25(21)14-11-16-9-10-19(26-2)20(15-16)27-3/h4-5,7-10,15H,6,11,13-14H2,1-3H3