2-ethoxy-6-[[(3S)-3-[4-(2-methylpropyl)-1H-pyrazol-5-yl]piperidin-1-yl]methyl]phenol

Systemtic Name: 2-ethoxy-6-[[(3S)-3-[4-(2-methylpropyl)-1H-pyrazol-5-yl]piperidin-1-yl]methyl]phenol Openeye Name: 2-ethoxy-6-[[(3S)-3-(4-isobutyl-1H-pyrazol-5-yl)-1-piperidyl]methyl]phenol CAS Name: 2-ethoxy-6-[[(3S)-3-[4-(2-methylpropyl)-1H-pyrazol-5-yl]-1-piperidinyl]methyl]phenol IUPAC Name: 2-ethoxy-6-[[(3S)-3-[4-(2-methylpropyl)-1H-pyrazol-5-yl]piperidin-1-yl]methyl]phenol Traditional Name: 2-ethoxy-6-[[(3S)-3-(4-isobutyl-1H-pyrazol-5-yl)piperidino]methyl]phenol Formula: C21H31N3O2 MolecularWeight: 357.48974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1O)CN2CCCC(C2)C3=C(C=NN3)CC(C)C

Isomeric SMILES

CCOC1=CC=CC(=C1O)CN2CCC[C@@H](C2)C3=C(C=NN3)CC(C)C

InChI

InChI=1S/C21H31N3O2/c1-4-26-19-9-5-7-17(21(19)25)14-24-10-6-8-16(13-24)20-18(11-15(2)3)12-22-23-20/h5,7,9,12,15-16,25H,4,6,8,10-11,13-14H2,1-3H3,(H,22,23)/t16-/m0/s1