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3-methylbutyl-[(3-pyrimidin-2-yloxyphenyl)methyl]azanium

3-methylbutyl-[(3-pyrimidin-2-yloxyphenyl)methyl]azanium

Systemtic Name:3-methylbutyl-[(3-pyrimidin-2-yloxyphenyl)methyl]azanium
Openeye Name:isopentyl-[(3-pyrimidin-2-yloxyphenyl)methyl]ammonium
CAS Name:3-methylbutyl-[[3-(2-pyrimidinyloxy)phenyl]methyl]ammonium
IUPAC Name:3-methylbutyl-[(3-pyrimidin-2-yloxyphenyl)methyl]azanium
Traditional Name:isoamyl-[3-(2-pyrimidyloxy)benzyl]ammonium
Formula: C16H22N3O+
MolecularWeight: 272.36538
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[NH2+]CC1=CC(=CC=C1)OC2=NC=CC=N2


Isomeric SMILES

CC(C)CC[NH2+]CC1=CC(=CC=C1)OC2=NC=CC=N2


InChI

InChI=1S/C16H21N3O/c1-13(2)7-10-17-12-14-5-3-6-15(11-14)20-16-18-8-4-9-19-16/h3-6,8-9,11,13,17H,7,10,12H2,1-2H3/p+1


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