4-[4-[[(1-cyclopentylpiperidin-4-yl)methyl-(pyridin-3-ylmethyl)amino]methyl]phenyl]but-3-yn-1-ol

Systemtic Name: 4-[4-[[(1-cyclopentylpiperidin-4-yl)methyl-(pyridin-3-ylmethyl)amino]methyl]phenyl]but-3-yn-1-ol Openeye Name: 4-[4-[[(1-cyclopentyl-4-piperidyl)methyl-(3-pyridylmethyl)amino]methyl]phenyl]but-3-yn-1-ol CAS Name: 4-[4-[[(1-cyclopentyl-4-piperidinyl)methyl-(3-pyridinylmethyl)amino]methyl]phenyl]-3-butyn-1-ol IUPAC Name: 4-[4-[[(1-cyclopentylpiperidin-4-yl)methyl-(pyridin-3-ylmethyl)amino]methyl]phenyl]but-3-yn-1-ol Traditional Name: 4-[4-[[(1-cyclopentyl-4-piperidyl)methyl-(3-pyridylmethyl)amino]methyl]phenyl]but-3-yn-1-ol Formula: C28H37N3O MolecularWeight: 431.61288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CCC(CC2)CN(CC3=CC=C(C=C3)C#CCCO)CC4=CN=CC=C4

Isomeric SMILES

C1CCC(C1)N2CCC(CC2)CN(CC3=CC=C(C=C3)C#CCCO)CC4=CN=CC=C4

InChI

InChI=1S/C28H37N3O/c32-19-4-3-6-24-10-12-25(13-11-24)21-30(23-27-7-5-16-29-20-27)22-26-14-17-31(18-15-26)28-8-1-2-9-28/h5,7,10-13,16,20,26,28,32H,1-2,4,8-9,14-15,17-19,21-23H2