[(1S)-1-(3-bromanyl-5-chloranyl-2-oxidanyl-phenyl)-3-ethoxy-3-oxidanylidene-propyl]azanium

Systemtic Name: [(1S)-1-(3-bromanyl-5-chloranyl-2-oxidanyl-phenyl)-3-ethoxy-3-oxidanylidene-propyl]azanium Openeye Name: [(1S)-1-(3-bromo-5-chloro-2-hydroxy-phenyl)-3-ethoxy-3-oxo-propyl]ammonium CAS Name: [(1S)-1-(3-bromo-5-chloro-2-hydroxyphenyl)-3-ethoxy-3-oxopropyl]ammonium IUPAC Name: [(1S)-1-(3-bromo-5-chloro-2-hydroxyphenyl)-3-ethoxy-3-oxopropyl]azanium Traditional Name: [(1S)-1-(3-bromo-5-chloro-2-hydroxy-phenyl)-3-ethoxy-3-keto-propyl]ammonium Formula: C11H14BrClNO3+ MolecularWeight: 323.59076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC(=CC(=C1O)Br)Cl)[NH3+]

Isomeric SMILES

CCOC(=O)C[C@@H](C1=CC(=CC(=C1O)Br)Cl)[NH3+]

InChI

InChI=1S/C11H13BrClNO3/c1-2-17-10(15)5-9(14)7-3-6(13)4-8(12)11(7)16/h3-4,9,16H,2,5,14H2,1H3/p+1/t9-/m0/s1