[(2S)-butan-2-yl]-[(3-pyrimidin-2-yloxyphenyl)methyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[(3-pyrimidin-2-yloxyphenyl)methyl]azanium Openeye Name: [(1S)-1-methylpropyl]-[(3-pyrimidin-2-yloxyphenyl)methyl]ammonium CAS Name: [(2S)-butan-2-yl]-[[3-(2-pyrimidinyloxy)phenyl]methyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[(3-pyrimidin-2-yloxyphenyl)methyl]azanium Traditional Name: [(1S)-1-methylpropyl]-[3-(2-pyrimidyloxy)benzyl]ammonium Formula: C15H20N3O+ MolecularWeight: 258.3388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O/c1-3-12(2)18-11-13-6-4-7-14(10-13)19-15-16-8-5-9-17-15/h4-10,12,18H,3,11H2,1-2H3/p+1/t12-/m0/s1