[(S)-(3-bromanyl-5-chloranyl-2-methoxy-phenyl)-[(2R)-oxolan-2-yl]methyl]azanium

Systemtic Name: [(S)-(3-bromanyl-5-chloranyl-2-methoxy-phenyl)-[(2R)-oxolan-2-yl]methyl]azanium Openeye Name: [(S)-(3-bromo-5-chloro-2-methoxy-phenyl)-[(2R)-tetrahydrofuran-2-yl]methyl]ammonium CAS Name: [(S)-(3-bromo-5-chloro-2-methoxyphenyl)-[(2R)-2-oxolanyl]methyl]ammonium IUPAC Name: [(S)-(3-bromo-5-chloro-2-methoxyphenyl)-[(2R)-oxolan-2-yl]methyl]azanium Traditional Name: [(S)-(3-bromo-5-chloro-2-methoxy-phenyl)-[(2R)-tetrahydrofuran-2-yl]methyl]ammonium Formula: C12H16BrClNO2+ MolecularWeight: 321.61794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C(C2CCCO2)[NH3+])Cl)Br

Isomeric SMILES

COC1=C(C=C(C=C1[C@@H]([C@H]2CCCO2)[NH3+])Cl)Br

InChI

InChI=1S/C12H15BrClNO2/c1-16-12-8(5-7(14)6-9(12)13)11(15)10-3-2-4-17-10/h5-6,10-11H,2-4,15H2,1H3/p+1/t10-,11+/m1/s1