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1-[2-[2-[(2S)-butan-2-yl]phenoxy]ethyl]piperazine-1,4-diium

1-[2-[2-[(2S)-butan-2-yl]phenoxy]ethyl]piperazine-1,4-diium

Systemtic Name:1-[2-[2-[(2S)-butan-2-yl]phenoxy]ethyl]piperazine-1,4-diium
Openeye Name:1-[2-[2-[(1S)-1-methylpropyl]phenoxy]ethyl]piperazine-1,4-diium
CAS Name:1-[2-[2-[(2S)-butan-2-yl]phenoxy]ethyl]piperazine-1,4-diium
IUPAC Name:1-[2-[2-[(2S)-butan-2-yl]phenoxy]ethyl]piperazine-1,4-diium
Traditional Name:1-[2-[2-[(1S)-1-methylpropyl]phenoxy]ethyl]piperazine-1,4-diium
Formula: C16H28N2O+2
MolecularWeight: 264.40632
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCC[NH+]2CC[NH2+]CC2


Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1OCC[NH+]2CC[NH2+]CC2


InChI

InChI=1S/C16H26N2O/c1-3-14(2)15-6-4-5-7-16(15)19-13-12-18-10-8-17-9-11-18/h4-7,14,17H,3,8-13H2,1-2H3/p+2/t14-/m0/s1


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