4-[4-[[(1-cyclopentylpiperidin-4-yl)methyl-(oxolan-2-ylmethyl)amino]methyl]phenyl]but-3-yn-1-ol

Systemtic Name: 4-[4-[[(1-cyclopentylpiperidin-4-yl)methyl-(oxolan-2-ylmethyl)amino]methyl]phenyl]but-3-yn-1-ol Openeye Name: 4-[4-[[(1-cyclopentyl-4-piperidyl)methyl-(tetrahydrofuran-2-ylmethyl)amino]methyl]phenyl]but-3-yn-1-ol CAS Name: 4-[4-[[(1-cyclopentyl-4-piperidinyl)methyl-(2-oxolanylmethyl)amino]methyl]phenyl]-3-butyn-1-ol IUPAC Name: 4-[4-[[(1-cyclopentylpiperidin-4-yl)methyl-(oxolan-2-ylmethyl)amino]methyl]phenyl]but-3-yn-1-ol Traditional Name: 4-[4-[[(1-cyclopentyl-4-piperidyl)methyl-(tetrahydrofurfuryl)amino]methyl]phenyl]but-3-yn-1-ol Formula: C27H40N2O2 MolecularWeight: 424.6187

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CCC(CC2)CN(CC3CCCO3)CC4=CC=C(C=C4)C#CCCO

Isomeric SMILES

C1CCC(C1)N2CCC(CC2)CN(CC3CCCO3)CC4=CC=C(C=C4)C#CCCO

InChI

InChI=1S/C27H40N2O2/c30-18-4-3-6-23-10-12-24(13-11-23)20-28(22-27-9-5-19-31-27)21-25-14-16-29(17-15-25)26-7-1-2-8-26/h10-13,25-27,30H,1-2,4-5,7-9,14-22H2