(2R)-2-azaniumyl-2-(5-bromanyl-2-propoxy-phenyl)ethanoate

Systemtic Name: (2R)-2-azaniumyl-2-(5-bromanyl-2-propoxy-phenyl)ethanoate Openeye Name: (2R)-2-azaniumyl-2-(5-bromo-2-propoxy-phenyl)acetate CAS Name: (2R)-2-ammonio-2-(5-bromo-2-propoxyphenyl)acetate IUPAC Name: (2R)-2-azaniumyl-2-(5-bromo-2-propoxyphenyl)acetate Traditional Name: (2R)-2-ammonio-2-(5-bromo-2-propoxy-phenyl)acetate Formula: C11H14BrNO3 MolecularWeight: 288.13776

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)C(C(=O)[O-])[NH3+]

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)[C@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C11H14BrNO3/c1-2-5-16-9-4-3-7(12)6-8(9)10(13)11(14)15/h3-4,6,10H,2,5,13H2,1H3,(H,14,15)/t10-/m1/s1