3-(2-bromanyl-4,6-dimethyl-phenoxy)propyl-[(2R)-butan-2-yl]azanium

Systemtic Name: 3-(2-bromanyl-4,6-dimethyl-phenoxy)propyl-[(2R)-butan-2-yl]azanium Openeye Name: 3-(2-bromo-4,6-dimethyl-phenoxy)propyl-[(1R)-1-methylpropyl]ammonium CAS Name: 3-(2-bromo-4,6-dimethylphenoxy)propyl-[(2R)-butan-2-yl]ammonium IUPAC Name: 3-(2-bromo-4,6-dimethylphenoxy)propyl-[(2R)-butan-2-yl]azanium Traditional Name: 3-(2-bromo-4,6-dimethyl-phenoxy)propyl-[(1R)-1-methylpropyl]ammonium Formula: C15H25BrNO+ MolecularWeight: 315.2691

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CCCOC1=C(C=C(C=C1Br)C)C

Isomeric SMILES

CC[C@@H](C)[NH2+]CCCOC1=C(C=C(C=C1Br)C)C

InChI

InChI=1S/C15H24BrNO/c1-5-13(4)17-7-6-8-18-15-12(3)9-11(2)10-14(15)16/h9-10,13,17H,5-8H2,1-4H3/p+1/t13-/m1/s1