2-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)ethyl-[(2R)-butan-2-yl]azanium

Systemtic Name: 2-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)ethyl-[(2R)-butan-2-yl]azanium Openeye Name: 2-(2-bromo-6-chloro-4-methyl-phenoxy)ethyl-[(1R)-1-methylpropyl]ammonium CAS Name: 2-(2-bromo-6-chloro-4-methylphenoxy)ethyl-[(2R)-butan-2-yl]ammonium IUPAC Name: 2-(2-bromo-6-chloro-4-methylphenoxy)ethyl-[(2R)-butan-2-yl]azanium Traditional Name: 2-(2-bromo-6-chloro-4-methyl-phenoxy)ethyl-[(1R)-1-methylpropyl]ammonium Formula: C13H20BrClNO+ MolecularWeight: 321.661

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CCOC1=C(C=C(C=C1Br)C)Cl

Isomeric SMILES

CC[C@@H](C)[NH2+]CCOC1=C(C=C(C=C1Br)C)Cl

InChI

InChI=1S/C13H19BrClNO/c1-4-10(3)16-5-6-17-13-11(14)7-9(2)8-12(13)15/h7-8,10,16H,4-6H2,1-3H3/p+1/t10-/m1/s1