[4-[(1R)-2-bromanyl-1-oxidanyl-ethyl]-2-(hydroxymethyl)phenyl] 2-phenylethanoate

Systemtic Name: [4-[(1R)-2-bromanyl-1-oxidanyl-ethyl]-2-(hydroxymethyl)phenyl] 2-phenylethanoate Openeye Name: [4-[(1R)-2-bromo-1-hydroxy-ethyl]-2-(hydroxymethyl)phenyl] 2-phenylacetate CAS Name: 2-phenylacetic acid [4-[(1R)-2-bromo-1-hydroxyethyl]-2-(hydroxymethyl)phenyl] ester IUPAC Name: [4-[(1R)-2-bromo-1-hydroxyethyl]-2-(hydroxymethyl)phenyl] 2-phenylacetate Traditional Name: 2-phenylacetic acid [4-[(1R)-2-bromo-1-hydroxy-ethyl]-2-methylol-phenyl] ester Formula: C17H17BrO4 MolecularWeight: 365.21848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)OC2=C(C=C(C=C2)C(CBr)O)CO

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)OC2=C(C=C(C=C2)[C@H](CBr)O)CO

InChI

InChI=1S/C17H17BrO4/c18-10-15(20)13-6-7-16(14(9-13)11-19)22-17(21)8-12-4-2-1-3-5-12/h1-7,9,15,19-20H,8,10-11H2/t15-/m0/s1