2-(5-oxidanylidene-3,4-dihydro-2H-1-benzoxepin-8-yl)ethanoic acid

Systemtic Name: 2-(5-oxidanylidene-3,4-dihydro-2H-1-benzoxepin-8-yl)ethanoic acid Openeye Name: 2-(5-oxo-3,4-dihydro-2H-1-benzoxepin-8-yl)acetic acid CAS Name: 2-(5-oxo-3,4-dihydro-2H-1-benzoxepin-8-yl)acetic acid IUPAC Name: 2-(5-oxo-3,4-dihydro-2H-1-benzoxepin-8-yl)acetic acid Traditional Name: 2-(5-keto-3,4-dihydro-2H-1-benzoxepin-8-yl)acetic acid Formula: C12H12O4 MolecularWeight: 220.22128

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C2=C(C=C(C=C2)CC(=O)O)OC1

Isomeric SMILES

C1CC(=O)C2=C(C=C(C=C2)CC(=O)O)OC1

InChI

InChI=1S/C12H12O4/c13-10-2-1-5-16-11-6-8(7-12(14)15)3-4-9(10)11/h3-4,6H,1-2,5,7H2,(H,14,15)