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2-[3-[4-(3-methylbutanoyl)piperazin-1-yl]phenoxy]ethylazanium

2-[3-[4-(3-methylbutanoyl)piperazin-1-yl]phenoxy]ethylazanium

Systemtic Name:2-[3-[4-(3-methylbutanoyl)piperazin-1-yl]phenoxy]ethylazanium
Openeye Name:2-[3-[4-(3-methylbutanoyl)piperazin-1-yl]phenoxy]ethylammonium
CAS Name:2-[3-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]phenoxy]ethylammonium
IUPAC Name:2-[3-[4-(3-methylbutanoyl)piperazin-1-yl]phenoxy]ethylazanium
Traditional Name:2-[3-(4-isovalerylpiperazino)phenoxy]ethylammonium
Formula: C17H28N3O2+
MolecularWeight: 306.42312
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(CC1)C2=CC(=CC=C2)OCC[NH3+]


Isomeric SMILES

CC(C)CC(=O)N1CCN(CC1)C2=CC(=CC=C2)OCC[NH3+]


InChI

InChI=1S/C17H27N3O2/c1-14(2)12-17(21)20-9-7-19(8-10-20)15-4-3-5-16(13-15)22-11-6-18/h3-5,13-14H,6-12,18H2,1-2H3/p+1


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