3-[[3-(1,3-benzodioxol-5-yloxy)-3-phenyl-propyl]-methyl-amino]propanenitrile

Systemtic Name: 3-[[3-(1,3-benzodioxol-5-yloxy)-3-phenyl-propyl]-methyl-amino]propanenitrile Openeye Name: 3-[[3-(1,3-benzodioxol-5-yloxy)-3-phenyl-propyl]-methyl-amino]propanenitrile CAS Name: 3-[[3-(1,3-benzodioxol-5-yloxy)-3-phenylpropyl]-methylamino]propanenitrile IUPAC Name: 3-[[3-(1,3-benzodioxol-5-yloxy)-3-phenylpropyl]-methylamino]propanenitrile Traditional Name: 3-[[3-(1,3-benzodioxol-5-yloxy)-3-phenyl-propyl]-methyl-amino]propionitrile Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)CCC(C1=CC=CC=C1)OC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN(CCC#N)CCC(C1=CC=CC=C1)OC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H22N2O3/c1-22(12-5-11-21)13-10-18(16-6-3-2-4-7-16)25-17-8-9-19-20(14-17)24-15-23-19/h2-4,6-9,14,18H,5,10,12-13,15H2,1H3