[(1R)-2-(1,3-benzoxazol-2-yl)-1-(2-bromanyl-5-methoxy-phenyl)ethyl]azanium

Systemtic Name: [(1R)-2-(1,3-benzoxazol-2-yl)-1-(2-bromanyl-5-methoxy-phenyl)ethyl]azanium Openeye Name: [(1R)-2-(1,3-benzoxazol-2-yl)-1-(2-bromo-5-methoxy-phenyl)ethyl]ammonium CAS Name: [(1R)-2-(1,3-benzoxazol-2-yl)-1-(2-bromo-5-methoxyphenyl)ethyl]ammonium IUPAC Name: [(1R)-2-(1,3-benzoxazol-2-yl)-1-(2-bromo-5-methoxyphenyl)ethyl]azanium Traditional Name: [(1R)-2-(1,3-benzoxazol-2-yl)-1-(2-bromo-5-methoxy-phenyl)ethyl]ammonium Formula: C16H16BrN2O2+ MolecularWeight: 348.21444

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(CC2=NC3=CC=CC=C3O2)[NH3+]

Isomeric SMILES

COC1=CC(=C(C=C1)Br)[C@@H](CC2=NC3=CC=CC=C3O2)[NH3+]

InChI

InChI=1S/C16H15BrN2O2/c1-20-10-6-7-12(17)11(8-10)13(18)9-16-19-14-4-2-3-5-15(14)21-16/h2-8,13H,9,18H2,1H3/p+1/t13-/m1/s1