(3S)-3-(5-bromanyl-2-oxidanyl-phenyl)-3-phenyl-propanoate

Systemtic Name: (3S)-3-(5-bromanyl-2-oxidanyl-phenyl)-3-phenyl-propanoate Openeye Name: (3S)-3-(5-bromo-2-hydroxy-phenyl)-3-phenyl-propanoate CAS Name: (3S)-3-(5-bromo-2-hydroxyphenyl)-3-phenylpropanoate IUPAC Name: (3S)-3-(5-bromo-2-hydroxyphenyl)-3-phenylpropanoate Traditional Name: (3S)-3-(5-bromo-2-hydroxy-phenyl)-3-phenyl-propionate Formula: C15H12BrO3- MolecularWeight: 320.15798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)[O-])C2=C(C=CC(=C2)Br)O

Isomeric SMILES

C1=CC=C(C=C1)[C@H](CC(=O)[O-])C2=C(C=CC(=C2)Br)O

InChI

InChI=1S/C15H13BrO3/c16-11-6-7-14(17)13(8-11)12(9-15(18)19)10-4-2-1-3-5-10/h1-8,12,17H,9H2,(H,18,19)/p-1/t12-/m0/s1