2-(2-bromanyl-4-chloranyl-6-methyl-phenoxy)ethyl-[(2S)-2-oxidanylpropyl]azanium

Systemtic Name: 2-(2-bromanyl-4-chloranyl-6-methyl-phenoxy)ethyl-[(2S)-2-oxidanylpropyl]azanium Openeye Name: 2-(2-bromo-4-chloro-6-methyl-phenoxy)ethyl-[(2S)-2-hydroxypropyl]ammonium CAS Name: 2-(2-bromo-4-chloro-6-methylphenoxy)ethyl-[(2S)-2-hydroxypropyl]ammonium IUPAC Name: 2-(2-bromo-4-chloro-6-methylphenoxy)ethyl-[(2S)-2-hydroxypropyl]azanium Traditional Name: 2-(2-bromo-4-chloro-6-methyl-phenoxy)ethyl-[(2S)-2-hydroxypropyl]ammonium Formula: C12H18BrClNO2+ MolecularWeight: 323.63382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC[NH2+]CC(C)O)Br)Cl

Isomeric SMILES

CC1=CC(=CC(=C1OCC[NH2+]C[C@H](C)O)Br)Cl

InChI

InChI=1S/C12H17BrClNO2/c1-8-5-10(14)6-11(13)12(8)17-4-3-15-7-9(2)16/h5-6,9,15-16H,3-4,7H2,1-2H3/p+1/t9-/m0/s1