1-(azocan-1-yl)-3-[2-methoxy-4-[[(1-methylpyrazol-4-yl)methylamino]methyl]phenoxy]propan-2-ol

Systemtic Name: 1-(azocan-1-yl)-3-[2-methoxy-4-[[(1-methylpyrazol-4-yl)methylamino]methyl]phenoxy]propan-2-ol Openeye Name: 1-(azocan-1-yl)-3-[2-methoxy-4-[[(1-methylpyrazol-4-yl)methylamino]methyl]phenoxy]propan-2-ol CAS Name: 1-(1-azocanyl)-3-[2-methoxy-4-[[(1-methyl-4-pyrazolyl)methylamino]methyl]phenoxy]-2-propanol IUPAC Name: 1-(azocan-1-yl)-3-[2-methoxy-4-[[(1-methylpyrazol-4-yl)methylamino]methyl]phenoxy]propan-2-ol Traditional Name: 1-(azocan-1-yl)-3-[2-methoxy-4-[[(1-methylpyrazol-4-yl)methylamino]methyl]phenoxy]propan-2-ol Formula: C23H36N4O3 MolecularWeight: 416.55694

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CNCC2=CC(=C(C=C2)OCC(CN3CCCCCCC3)O)OC

Isomeric SMILES

CN1C=C(C=N1)CNCC2=CC(=C(C=C2)OCC(CN3CCCCCCC3)O)OC

InChI

InChI=1S/C23H36N4O3/c1-26-16-20(15-25-26)14-24-13-19-8-9-22(23(12-19)29-2)30-18-21(28)17-27-10-6-4-3-5-7-11-27/h8-9,12,15-16,21,24,28H,3-7,10-11,13-14,17-18H2,1-2H3