2-[3-[[3-[4-(2-methylpropyl)-1H-pyrazol-5-yl]piperidin-1-yl]methyl]phenoxy]ethanol

Systemtic Name: 2-[3-[[3-[4-(2-methylpropyl)-1H-pyrazol-5-yl]piperidin-1-yl]methyl]phenoxy]ethanol Openeye Name: 2-[3-[[3-(4-isobutyl-1H-pyrazol-5-yl)-1-piperidyl]methyl]phenoxy]ethanol CAS Name: 2-[3-[[3-[4-(2-methylpropyl)-1H-pyrazol-5-yl]-1-piperidinyl]methyl]phenoxy]ethanol IUPAC Name: 2-[3-[[3-[4-(2-methylpropyl)-1H-pyrazol-5-yl]piperidin-1-yl]methyl]phenoxy]ethanol Traditional Name: 2-[3-[[3-(4-isobutyl-1H-pyrazol-5-yl)piperidino]methyl]phenoxy]ethanol Formula: C21H31N3O2 MolecularWeight: 357.48974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(NN=C1)C2CCCN(C2)CC3=CC(=CC=C3)OCCO

Isomeric SMILES

CC(C)CC1=C(NN=C1)C2CCCN(C2)CC3=CC(=CC=C3)OCCO

InChI

InChI=1S/C21H31N3O2/c1-16(2)11-19-13-22-23-21(19)18-6-4-8-24(15-18)14-17-5-3-7-20(12-17)26-10-9-25/h3,5,7,12-13,16,18,25H,4,6,8-11,14-15H2,1-2H3,(H,22,23)