1-[[3-(1,3-benzodioxol-5-yl)-1-(phenylmethyl)pyrazol-4-yl]methyl]-4-methoxy-piperidine

Systemtic Name: 1-[[3-(1,3-benzodioxol-5-yl)-1-(phenylmethyl)pyrazol-4-yl]methyl]-4-methoxy-piperidine Openeye Name: 1-[[3-(1,3-benzodioxol-5-yl)-1-benzyl-pyrazol-4-yl]methyl]-4-methoxy-piperidine CAS Name: 1-[[3-(1,3-benzodioxol-5-yl)-1-(phenylmethyl)-4-pyrazolyl]methyl]-4-methoxypiperidine IUPAC Name: 1-[[3-(1,3-benzodioxol-5-yl)-1-benzylpyrazol-4-yl]methyl]-4-methoxypiperidine Traditional Name: 1-[[3-(1,3-benzodioxol-5-yl)-1-benzyl-pyrazol-4-yl]methyl]-4-methoxy-piperidine Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCN(CC1)CC2=CN(N=C2C3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5

Isomeric SMILES

COC1CCN(CC1)CC2=CN(N=C2C3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5

InChI

InChI=1S/C24H27N3O3/c1-28-21-9-11-26(12-10-21)15-20-16-27(14-18-5-3-2-4-6-18)25-24(20)19-7-8-22-23(13-19)30-17-29-22/h2-8,13,16,21H,9-12,14-15,17H2,1H3