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

Systemtic Name: 2-(4-bromanyl-2-chloranyl-phenoxy)ethyl-[(2R)-butan-2-yl]azanium Openeye Name: 2-(4-bromo-2-chloro-phenoxy)ethyl-[(1R)-1-methylpropyl]ammonium CAS Name: 2-(4-bromo-2-chlorophenoxy)ethyl-[(2R)-butan-2-yl]ammonium IUPAC Name: 2-(4-bromo-2-chlorophenoxy)ethyl-[(2R)-butan-2-yl]azanium Traditional Name: 2-(4-bromo-2-chloro-phenoxy)ethyl-[(1R)-1-methylpropyl]ammonium Formula: C12H18BrClNO+ MolecularWeight: 307.63442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17BrClNO/c1-3-9(2)15-6-7-16-12-5-4-10(13)8-11(12)14/h4-5,8-9,15H,3,6-7H2,1-2H3/p+1/t9-/m1/s1