1-[4-[4-diazenyl-3-(2-ethylhexoxy)phenyl]piperazin-1-yl]-2-ethyl-hexan-1-one

Systemtic Name: 1-[4-[4-diazenyl-3-(2-ethylhexoxy)phenyl]piperazin-1-yl]-2-ethyl-hexan-1-one Openeye Name: 1-[4-[4-diazenyl-3-(2-ethylhexoxy)phenyl]piperazin-1-yl]-2-ethyl-hexan-1-one CAS Name: 1-[4-[4-diazenyl-3-(2-ethylhexoxy)phenyl]-1-piperazinyl]-2-ethyl-1-hexanone IUPAC Name: 1-[4-[4-diazenyl-3-(2-ethylhexoxy)phenyl]piperazin-1-yl]-2-ethylhexan-1-one Traditional Name: 1-[4-[4-diazenyl-3-(2-ethylhexoxy)phenyl]piperazino]-2-ethyl-hexan-1-one Formula: C26H44N4O2 MolecularWeight: 444.65316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC1=C(C=CC(=C1)N2CCN(CC2)C(=O)C(CC)CCCC)N=N

Isomeric SMILES

CCCCC(CC)COC1=C(C=CC(=C1)N2CCN(CC2)C(=O)C(CC)CCCC)N=N

InChI

InChI=1S/C26H44N4O2/c1-5-9-11-21(7-3)20-32-25-19-23(13-14-24(25)28-27)29-15-17-30(18-16-29)26(31)22(8-4)12-10-6-2/h13-14,19,21-22,27H,5-12,15-18,20H2,1-4H3