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2-(4-hexylphenoxy)-1-[4-(phenylmethyl)piperazin-1-yl]pentan-1-one

2-(4-hexylphenoxy)-1-[4-(phenylmethyl)piperazin-1-yl]pentan-1-one

Systemtic Name:2-(4-hexylphenoxy)-1-[4-(phenylmethyl)piperazin-1-yl]pentan-1-one
Openeye Name:1-(4-benzylpiperazin-1-yl)-2-(4-hexylphenoxy)pentan-1-one
CAS Name:2-(4-hexylphenoxy)-1-[4-(phenylmethyl)-1-piperazinyl]-1-pentanone
IUPAC Name:1-(4-benzylpiperazin-1-yl)-2-(4-hexylphenoxy)pentan-1-one
Traditional Name:1-(4-benzylpiperazino)-2-(4-hexylphenoxy)pentan-1-one
Formula: C28H40N2O2
MolecularWeight: 436.6294
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)OC(CCC)C(=O)N2CCN(CC2)CC3=CC=CC=C3


Isomeric SMILES

CCCCCCC1=CC=C(C=C1)OC(CCC)C(=O)N2CCN(CC2)CC3=CC=CC=C3


InChI

InChI=1S/C28H40N2O2/c1-3-5-6-8-12-24-15-17-26(18-16-24)32-27(11-4-2)28(31)30-21-19-29(20-22-30)23-25-13-9-7-10-14-25/h7,9-10,13-18,27H,3-6,8,11-12,19-23H2,1-2H3


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