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

Systemtic Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-oxidanylidene-pentanoic acid Openeye Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-oxo-pentanoic acid CAS Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-oxopentanoic acid IUPAC Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-oxopentanoic acid Traditional Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-keto-valeric acid Formula: C14H16O5 MolecularWeight: 264.27384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16O5/c15-11(3-1-4-14(16)17)10-5-6-12-13(9-10)19-8-2-7-18-12/h5-6,9H,1-4,7-8H2,(H,16,17)