N-[[3-(4-piperidin-1-ylbut-1-ynyl)phenyl]methyl]aniline

Systemtic Name: N-[[3-(4-piperidin-1-ylbut-1-ynyl)phenyl]methyl]aniline Openeye Name: N-[[3-[4-(1-piperidyl)but-1-ynyl]phenyl]methyl]aniline CAS Name: N-[[3-[4-(1-piperidinyl)but-1-ynyl]phenyl]methyl]aniline IUPAC Name: N-[[3-(4-piperidin-1-ylbut-1-ynyl)phenyl]methyl]aniline Traditional Name: phenyl-[3-(4-piperidinobut-1-ynyl)benzyl]amine Formula: C22H26N2 MolecularWeight: 318.45524

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC#CC2=CC(=CC=C2)CNC3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)CCC#CC2=CC(=CC=C2)CNC3=CC=CC=C3

InChI

InChI=1S/C22H26N2/c1-3-13-22(14-4-1)23-19-21-12-9-11-20(18-21)10-5-8-17-24-15-6-2-7-16-24/h1,3-4,9,11-14,18,23H,2,6-8,15-17,19H2