1-[3-[[3-(azocan-1-ylcarbonyl)-1H-pyrazol-5-yl]methoxy]phenyl]ethanone

Systemtic Name: 1-[3-[[3-(azocan-1-ylcarbonyl)-1H-pyrazol-5-yl]methoxy]phenyl]ethanone Openeye Name: 1-[3-[[3-(azocane-1-carbonyl)-1H-pyrazol-5-yl]methoxy]phenyl]ethanone CAS Name: 1-[3-[[3-[1-azocanyl(oxo)methyl]-1H-pyrazol-5-yl]methoxy]phenyl]ethanone IUPAC Name: 1-[3-[[3-(azocane-1-carbonyl)-1H-pyrazol-5-yl]methoxy]phenyl]ethanone Traditional Name: 1-[3-[[3-(azocane-1-carbonyl)-1H-pyrazol-5-yl]methoxy]phenyl]ethanone Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)OCC2=CC(=NN2)C(=O)N3CCCCCCC3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)OCC2=CC(=NN2)C(=O)N3CCCCCCC3

InChI

InChI=1S/C20H25N3O3/c1-15(24)16-8-7-9-18(12-16)26-14-17-13-19(22-21-17)20(25)23-10-5-3-2-4-6-11-23/h7-9,12-13H,2-6,10-11,14H2,1H3,(H,21,22)