(4R)-4-azaniumyl-4-(5-bromanyl-2-methoxy-phenyl)butanoate

Systemtic Name: (4R)-4-azaniumyl-4-(5-bromanyl-2-methoxy-phenyl)butanoate Openeye Name: (4R)-4-azaniumyl-4-(5-bromo-2-methoxy-phenyl)butanoate CAS Name: (4R)-4-ammonio-4-(5-bromo-2-methoxyphenyl)butanoate IUPAC Name: (4R)-4-azaniumyl-4-(5-bromo-2-methoxyphenyl)butanoate Traditional Name: (4R)-4-ammonio-4-(5-bromo-2-methoxy-phenyl)butyrate Formula: C11H14BrNO3 MolecularWeight: 288.13776

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(CCC(=O)[O-])[NH3+]

Isomeric SMILES

COC1=C(C=C(C=C1)Br)[C@@H](CCC(=O)[O-])[NH3+]

InChI

InChI=1S/C11H14BrNO3/c1-16-10-4-2-7(12)6-8(10)9(13)3-5-11(14)15/h2,4,6,9H,3,5,13H2,1H3,(H,14,15)/t9-/m1/s1