2-(5-oxidanylidene-6H-benzo[b][1]benzoxepin-3-yl)butanoic acid

Systemtic Name: 2-(5-oxidanylidene-6H-benzo[b][1]benzoxepin-3-yl)butanoic acid Openeye Name: 2-(5-oxo-6H-benzo[b][1]benzoxepin-3-yl)butanoic acid CAS Name: 2-(5-oxo-6H-benzo[b][1]benzoxepin-3-yl)butanoic acid IUPAC Name: 2-(5-oxo-6H-benzo[b][1]benzoxepin-3-yl)butanoic acid Traditional Name: 2-(5-keto-6H-benzo[b][1]benzoxepin-3-yl)butyric acid Formula: C18H16O4 MolecularWeight: 296.31724

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1)OC3=CC=CC=C3CC2=O)C(=O)O

Isomeric SMILES

CCC(C1=CC2=C(C=C1)OC3=CC=CC=C3CC2=O)C(=O)O

InChI

InChI=1S/C18H16O4/c1-2-13(18(20)21)11-7-8-17-14(9-11)15(19)10-12-5-3-4-6-16(12)22-17/h3-9,13H,2,10H2,1H3,(H,20,21)