1-(azepan-1-yl)-3-[4-[[(1,3-dimethylpyrazol-4-yl)methylamino]methyl]-2-methoxy-phenoxy]propan-2-ol

Systemtic Name: 1-(azepan-1-yl)-3-[4-[[(1,3-dimethylpyrazol-4-yl)methylamino]methyl]-2-methoxy-phenoxy]propan-2-ol Openeye Name: 1-(azepan-1-yl)-3-[4-[[(1,3-dimethylpyrazol-4-yl)methylamino]methyl]-2-methoxy-phenoxy]propan-2-ol CAS Name: 1-(1-azepanyl)-3-[4-[[(1,3-dimethyl-4-pyrazolyl)methylamino]methyl]-2-methoxyphenoxy]-2-propanol IUPAC Name: 1-(azepan-1-yl)-3-[4-[[(1,3-dimethylpyrazol-4-yl)methylamino]methyl]-2-methoxyphenoxy]propan-2-ol Traditional Name: 1-(azepan-1-yl)-3-[4-[[(1,3-dimethylpyrazol-4-yl)methylamino]methyl]-2-methoxy-phenoxy]propan-2-ol Formula: C23H36N4O3 MolecularWeight: 416.55694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CNCC2=CC(=C(C=C2)OCC(CN3CCCCCC3)O)OC)C

Isomeric SMILES

CC1=NN(C=C1CNCC2=CC(=C(C=C2)OCC(CN3CCCCCC3)O)OC)C

InChI

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