4-[4-[[(3S)-3-(2-hydroxyethyl)-4-propan-2-yl-piperazin-1-yl]methyl]phenyl]but-3-yn-1-ol

Systemtic Name: 4-[4-[[(3S)-3-(2-hydroxyethyl)-4-propan-2-yl-piperazin-1-yl]methyl]phenyl]but-3-yn-1-ol Openeye Name: 4-[4-[[(3S)-3-(2-hydroxyethyl)-4-isopropyl-piperazin-1-yl]methyl]phenyl]but-3-yn-1-ol CAS Name: 4-[4-[[(3S)-3-(2-hydroxyethyl)-4-propan-2-yl-1-piperazinyl]methyl]phenyl]-3-butyn-1-ol IUPAC Name: 4-[4-[[(3S)-3-(2-hydroxyethyl)-4-propan-2-ylpiperazin-1-yl]methyl]phenyl]but-3-yn-1-ol Traditional Name: 4-[4-[[(3S)-3-(2-hydroxyethyl)-4-isopropyl-piperazino]methyl]phenyl]but-3-yn-1-ol Formula: C20H30N2O2 MolecularWeight: 330.4644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1CCO)CC2=CC=C(C=C2)C#CCCO

Isomeric SMILES

CC(C)N1CCN(C[C@@H]1CCO)CC2=CC=C(C=C2)C#CCCO

InChI

InChI=1S/C20H30N2O2/c1-17(2)22-12-11-21(16-20(22)10-14-24)15-19-8-6-18(7-9-19)5-3-4-13-23/h6-9,17,20,23-24H,4,10-16H2,1-2H3/t20-/m0/s1