propan-2-yl (2S)-3-[3,5-bis(bromanyl)-4-oxidanyl-phenyl]-2-ethoxy-propanoate

Systemtic Name: propan-2-yl (2S)-3-[3,5-bis(bromanyl)-4-oxidanyl-phenyl]-2-ethoxy-propanoate Openeye Name: isopropyl (2S)-3-(3,5-dibromo-4-hydroxy-phenyl)-2-ethoxy-propanoate CAS Name: (2S)-3-(3,5-dibromo-4-hydroxyphenyl)-2-ethoxypropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (2S)-3-(3,5-dibromo-4-hydroxyphenyl)-2-ethoxypropanoate Traditional Name: (2S)-3-(3,5-dibromo-4-hydroxy-phenyl)-2-ethoxy-propionic acid isopropyl ester Formula: C14H18Br2O4 MolecularWeight: 410.09832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC(=C(C(=C1)Br)O)Br)C(=O)OC(C)C

Isomeric SMILES

CCO[C@@H](CC1=CC(=C(C(=C1)Br)O)Br)C(=O)OC(C)C

InChI

InChI=1S/C14H18Br2O4/c1-4-19-12(14(18)20-8(2)3)7-9-5-10(15)13(17)11(16)6-9/h5-6,8,12,17H,4,7H2,1-3H3/t12-/m0/s1