2-ethyl-3-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]-1H-pyrazol-5-one

Systemtic Name: 2-ethyl-3-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]-1H-pyrazol-5-one Openeye Name: 2-ethyl-3-[3-[3-(1-piperidylmethyl)phenoxy]propylamino]-1H-pyrazol-5-one CAS Name: 2-ethyl-3-[3-[3-(1-piperidinylmethyl)phenoxy]propylamino]-1H-pyrazol-5-one IUPAC Name: 2-ethyl-3-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]-1H-pyrazol-5-one Traditional Name: 1-ethyl-5-[3-[3-(piperidinomethyl)phenoxy]propylamino]-3-pyrazolin-3-one Formula: C20H30N4O2 MolecularWeight: 358.4778

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=O)N1)NCCCOC2=CC=CC(=C2)CN3CCCCC3

Isomeric SMILES

CCN1C(=CC(=O)N1)NCCCOC2=CC=CC(=C2)CN3CCCCC3

InChI

InChI=1S/C20H30N4O2/c1-2-24-19(15-20(25)22-24)21-10-7-13-26-18-9-6-8-17(14-18)16-23-11-4-3-5-12-23/h6,8-9,14-15,21H,2-5,7,10-13,16H2,1H3,(H,22,25)