5-(7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-oxidanyl-pentanoic acid

Systemtic Name: 5-(7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-oxidanyl-pentanoic acid Openeye Name: 5-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-hydroxy-pentanoic acid CAS Name: 5-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-hydroxypentanoic acid IUPAC Name: 5-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-hydroxypentanoic acid Traditional Name: 5-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-hydroxy-valeric acid Formula: C14H17BrO5 MolecularWeight: 345.18578

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C(=C2)C(CCCC(=O)O)O)Br)OC1

Isomeric SMILES

C1COC2=C(C=C(C(=C2)C(CCCC(=O)O)O)Br)OC1

InChI

InChI=1S/C14H17BrO5/c15-10-8-13-12(19-5-2-6-20-13)7-9(10)11(16)3-1-4-14(17)18/h7-8,11,16H,1-6H2,(H,17,18)