2-(4-bromanylphenoxy)ethyl-[(2S)-butan-2-yl]azanium

Systemtic Name: 2-(4-bromanylphenoxy)ethyl-[(2S)-butan-2-yl]azanium Openeye Name: 2-(4-bromophenoxy)ethyl-[(1S)-1-methylpropyl]ammonium CAS Name: 2-(4-bromophenoxy)ethyl-[(2S)-butan-2-yl]ammonium IUPAC Name: 2-(4-bromophenoxy)ethyl-[(2S)-butan-2-yl]azanium Traditional Name: 2-(4-bromophenoxy)ethyl-[(1S)-1-methylpropyl]ammonium Formula: C12H19BrNO+ MolecularWeight: 273.18936

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CCOC1=CC=C(C=C1)Br

Isomeric SMILES

CC[C@H](C)[NH2+]CCOC1=CC=C(C=C1)Br

InChI

InChI=1S/C12H18BrNO/c1-3-10(2)14-8-9-15-12-6-4-11(13)5-7-12/h4-7,10,14H,3,8-9H2,1-2H3/p+1/t10-/m0/s1