[(2R)-2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)propyl]azanium

Systemtic Name: [(2R)-2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)propyl]azanium Openeye Name: [(2R)-2-(4-bromo-2-isopropyl-5-methyl-phenoxy)propyl]ammonium CAS Name: [(2R)-2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)propyl]ammonium IUPAC Name: [(2R)-2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)propyl]azanium Traditional Name: [(2R)-2-(4-bromo-2-isopropyl-5-methyl-phenoxy)propyl]ammonium Formula: C13H21BrNO+ MolecularWeight: 287.21594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C(C)C)OC(C)C[NH3+]

Isomeric SMILES

CC1=CC(=C(C=C1Br)C(C)C)O[C@H](C)C[NH3+]

InChI

InChI=1S/C13H20BrNO/c1-8(2)11-6-12(14)9(3)5-13(11)16-10(4)7-15/h5-6,8,10H,7,15H2,1-4H3/p+1/t10-/m1/s1