2-(8-bromanylphenoxathiin-2-yl)-2-oxidanyl-propanoic acid

Systemtic Name: 2-(8-bromanylphenoxathiin-2-yl)-2-oxidanyl-propanoic acid Openeye Name: 2-(8-bromophenoxathiin-2-yl)-2-hydroxy-propanoic acid CAS Name: 2-(8-bromo-2-phenoxathiinyl)-2-hydroxypropanoic acid IUPAC Name: 2-(8-bromophenoxathiin-2-yl)-2-hydroxypropanoic acid Traditional Name: 2-(8-bromophenoxathiin-2-yl)-2-hydroxy-propionic acid Formula: C15H11BrO4S MolecularWeight: 367.21444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OC3=C(S2)C=C(C=C3)Br)(C(=O)O)O

Isomeric SMILES

CC(C1=CC2=C(C=C1)OC3=C(S2)C=C(C=C3)Br)(C(=O)O)O

InChI

InChI=1S/C15H11BrO4S/c1-15(19,14(17)18)8-2-4-10-12(6-8)21-13-7-9(16)3-5-11(13)20-10/h2-7,19H,1H3,(H,17,18)