2-[4-[(3-piperidin-1-ylpropylamino)methyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(3-piperidin-1-ylpropylamino)methyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[[3-(1-piperidyl)propylamino]methyl]phenoxy]acetonitrile CAS Name: 2-[4-[[3-(1-piperidinyl)propylamino]methyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[(3-piperidin-1-ylpropylamino)methyl]phenoxy]acetonitrile Traditional Name: 2-[4-[(3-piperidinopropylamino)methyl]phenoxy]acetonitrile Formula: C17H25N3O MolecularWeight: 287.3999

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCNCC2=CC=C(C=C2)OCC#N

Isomeric SMILES

C1CCN(CC1)CCCNCC2=CC=C(C=C2)OCC#N

InChI

InChI=1S/C17H25N3O/c18-9-14-21-17-7-5-16(6-8-17)15-19-10-4-13-20-11-2-1-3-12-20/h5-8,19H,1-4,10-15H2