[1-[[3-(4-piperidin-1-ylbut-1-ynyl)phenyl]methyl]piperidin-4-yl] carbamate

Systemtic Name: [1-[[3-(4-piperidin-1-ylbut-1-ynyl)phenyl]methyl]piperidin-4-yl] carbamate Openeye Name: [1-[[3-[4-(1-piperidyl)but-1-ynyl]phenyl]methyl]-4-piperidyl] carbamate CAS Name: carbamic acid [1-[[3-[4-(1-piperidinyl)but-1-ynyl]phenyl]methyl]-4-piperidinyl] ester IUPAC Name: [1-[[3-(4-piperidin-1-ylbut-1-ynyl)phenyl]methyl]piperidin-4-yl] carbamate Traditional Name: carbamic acid [1-[3-(4-piperidinobut-1-ynyl)benzyl]-4-piperidyl] ester Formula: C22H31N3O2 MolecularWeight: 369.50044

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC#CC2=CC(=CC=C2)CN3CCC(CC3)OC(=O)N

Isomeric SMILES

C1CCN(CC1)CCC#CC2=CC(=CC=C2)CN3CCC(CC3)OC(=O)N

InChI

InChI=1S/C22H31N3O2/c23-22(26)27-21-10-15-25(16-11-21)18-20-9-6-8-19(17-20)7-2-5-14-24-12-3-1-4-13-24/h6,8-9,17,21H,1,3-5,10-16,18H2,(H2,23,26)