[(2S)-butan-2-yl]-[(2-prop-2-ynoxyphenyl)methyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[(2-prop-2-ynoxyphenyl)methyl]azanium Openeye Name: [(1S)-1-methylpropyl]-[(2-prop-2-ynoxyphenyl)methyl]ammonium CAS Name: [(2S)-butan-2-yl]-[(2-prop-2-ynoxyphenyl)methyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[(2-prop-2-ynoxyphenyl)methyl]azanium Traditional Name: [(1S)-1-methylpropyl]-(2-propargyloxybenzyl)ammonium Formula: C14H20NO+ MolecularWeight: 218.3147

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CC1=CC=CC=C1OCC#C

Isomeric SMILES

CC[C@H](C)[NH2+]CC1=CC=CC=C1OCC#C

InChI

InChI=1S/C14H19NO/c1-4-10-16-14-9-7-6-8-13(14)11-15-12(3)5-2/h1,6-9,12,15H,5,10-11H2,2-3H3/p+1/t12-/m0/s1