6-(7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-(7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-6-oxidanylidene-hexanoic acid Openeye Name: 6-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-6-oxo-hexanoic acid CAS Name: 6-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-6-oxohexanoic acid IUPAC Name: 6-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-6-oxohexanoic acid Traditional Name: 6-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-6-keto-hexanoic acid Formula: C15H17BrO5 MolecularWeight: 357.19648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17BrO5/c16-11-9-14-13(20-6-3-7-21-14)8-10(11)12(17)4-1-2-5-15(18)19/h8-9H,1-7H2,(H,18,19)