2-[[3-(4-piperidin-1-ylbut-1-ynyl)phenyl]methyl]-1,5,8,2-trioxazecane

Systemtic Name: 2-[[3-(4-piperidin-1-ylbut-1-ynyl)phenyl]methyl]-1,5,8,2-trioxazecane Openeye Name: 2-[[3-[4-(1-piperidyl)but-1-ynyl]phenyl]methyl]-1,5,8,2-trioxazecane CAS Name: 2-[[3-[4-(1-piperidinyl)but-1-ynyl]phenyl]methyl]-1,5,8,2-trioxazecane IUPAC Name: 2-[[3-(4-piperidin-1-ylbut-1-ynyl)phenyl]methyl]-1,5,8,2-trioxazecane Traditional Name: 2-[3-(4-piperidinobut-1-ynyl)benzyl]-1,5,8,2-trioxazecane Formula: C22H32N2O3 MolecularWeight: 372.50108

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC#CC2=CC(=CC=C2)CN3CCOCCOCCO3

Isomeric SMILES

C1CCN(CC1)CCC#CC2=CC(=CC=C2)CN3CCOCCOCCO3

InChI

InChI=1S/C22H32N2O3/c1-3-10-23(11-4-1)12-5-2-7-21-8-6-9-22(19-21)20-24-13-14-25-15-16-26-17-18-27-24/h6,8-9,19H,1,3-5,10-18,20H2