[(1S,2S)-1-(3-bromanyl-5-chloranyl-2-methoxy-phenyl)-2-methyl-butyl]azanium

Systemtic Name: [(1S,2S)-1-(3-bromanyl-5-chloranyl-2-methoxy-phenyl)-2-methyl-butyl]azanium Openeye Name: [(1S,2S)-1-(3-bromo-5-chloro-2-methoxy-phenyl)-2-methyl-butyl]ammonium CAS Name: [(1S,2S)-1-(3-bromo-5-chloro-2-methoxyphenyl)-2-methylbutyl]ammonium IUPAC Name: [(1S,2S)-1-(3-bromo-5-chloro-2-methoxyphenyl)-2-methylbutyl]azanium Traditional Name: [(1S,2S)-1-(3-bromo-5-chloro-2-methoxy-phenyl)-2-methyl-butyl]ammonium Formula: C12H18BrClNO+ MolecularWeight: 307.63442

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=CC(=CC(=C1OC)Br)Cl)[NH3+]

Isomeric SMILES

CC[C@H](C)[C@@H](C1=CC(=CC(=C1OC)Br)Cl)[NH3+]

InChI

InChI=1S/C12H17BrClNO/c1-4-7(2)11(15)9-5-8(14)6-10(13)12(9)16-3/h5-7,11H,4,15H2,1-3H3/p+1/t7-,11-/m0/s1