[(2S)-3-(2-bromanyl-4-methyl-phenoxy)-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: [(2S)-3-(2-bromanyl-4-methyl-phenoxy)-2-oxidanyl-propyl]-methyl-azanium Openeye Name: [(2S)-3-(2-bromo-4-methyl-phenoxy)-2-hydroxy-propyl]-methyl-ammonium CAS Name: [(2S)-3-(2-bromo-4-methylphenoxy)-2-hydroxypropyl]-methylammonium IUPAC Name: [(2S)-3-(2-bromo-4-methylphenoxy)-2-hydroxypropyl]-methylazanium Traditional Name: [(2S)-3-(2-bromo-4-methyl-phenoxy)-2-hydroxy-propyl]-methyl-ammonium Formula: C11H17BrNO2+ MolecularWeight: 275.16218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(C[NH2+]C)O)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OC[C@H](C[NH2+]C)O)Br

InChI

InChI=1S/C11H16BrNO2/c1-8-3-4-11(10(12)5-8)15-7-9(14)6-13-2/h3-5,9,13-14H,6-7H2,1-2H3/p+1/t9-/m0/s1