4-[6-[3-(piperidin-1-ylmethyl)phenoxy]hexyl]-1H-pyrazole-3,5-diamine

Systemtic Name: 4-[6-[3-(piperidin-1-ylmethyl)phenoxy]hexyl]-1H-pyrazole-3,5-diamine Openeye Name: 4-[6-[3-(1-piperidylmethyl)phenoxy]hexyl]-1H-pyrazole-3,5-diamine CAS Name: 4-[6-[3-(1-piperidinylmethyl)phenoxy]hexyl]-1H-pyrazole-3,5-diamine IUPAC Name: 4-[6-[3-(piperidin-1-ylmethyl)phenoxy]hexyl]-1H-pyrazole-3,5-diamine Traditional Name: [3-amino-4-[6-[3-(piperidinomethyl)phenoxy]hexyl]-1H-pyrazol-5-yl]amine Formula: C21H33N5O MolecularWeight: 371.51962

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=CC=C2)OCCCCCCC3=C(NN=C3N)N

Isomeric SMILES

C1CCN(CC1)CC2=CC(=CC=C2)OCCCCCCC3=C(NN=C3N)N

InChI

InChI=1S/C21H33N5O/c22-20-19(21(23)25-24-20)11-4-1-2-7-14-27-18-10-8-9-17(15-18)16-26-12-5-3-6-13-26/h8-10,15H,1-7,11-14,16H2,(H5,22,23,24,25)