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1-[1-(2,5-dibutoxyphenyl)piperazin-1-ium-1-yl]-2-ethyl-hexan-1-one

1-[1-(2,5-dibutoxyphenyl)piperazin-1-ium-1-yl]-2-ethyl-hexan-1-one

Systemtic Name:1-[1-(2,5-dibutoxyphenyl)piperazin-1-ium-1-yl]-2-ethyl-hexan-1-one
Openeye Name:1-[1-(2,5-dibutoxyphenyl)piperazin-1-ium-1-yl]-2-ethyl-hexan-1-one
CAS Name:1-[1-(2,5-dibutoxyphenyl)-1-piperazin-1-iumyl]-2-ethyl-1-hexanone
IUPAC Name:1-[1-(2,5-dibutoxyphenyl)piperazin-1-ium-1-yl]-2-ethylhexan-1-one
Traditional Name:1-[1-(2,5-dibutoxyphenyl)piperazin-1-ium-1-yl]-2-ethyl-hexan-1-one
Formula: C26H45N2O3+
MolecularWeight: 433.6471
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)[N+]1(CCNCC1)C2=C(C=CC(=C2)OCCCC)OCCCC


Isomeric SMILES

CCCCC(CC)C(=O)[N+]1(CCNCC1)C2=C(C=CC(=C2)OCCCC)OCCCC


InChI

InChI=1S/C26H45N2O3/c1-5-9-12-22(8-4)26(29)28(17-15-27-16-18-28)24-21-23(30-19-10-6-2)13-14-25(24)31-20-11-7-3/h13-14,21-22,27H,5-12,15-20H2,1-4H3/q+1


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