2-(9-ethyl-11-oxidanylidene-6H-benzo[c][1]benzoxepin-3-yl)ethanoic acid

Systemtic Name: 2-(9-ethyl-11-oxidanylidene-6H-benzo[c][1]benzoxepin-3-yl)ethanoic acid Openeye Name: 2-(9-ethyl-11-oxo-6H-benzo[c][1]benzoxepin-3-yl)acetic acid CAS Name: 2-(9-ethyl-11-oxo-6H-benzo[c][1]benzoxepin-3-yl)acetic acid IUPAC Name: 2-(9-ethyl-11-oxo-6H-benzo[c][1]benzoxepin-3-yl)acetic acid Traditional Name: 2-(9-ethyl-11-keto-6H-benzo[c][1]benzoxepin-3-yl)acetic acid Formula: C18H16O4 MolecularWeight: 296.31724

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(COC3=C(C2=O)C=CC(=C3)CC(=O)O)C=C1

Isomeric SMILES

CCC1=CC2=C(COC3=C(C2=O)C=CC(=C3)CC(=O)O)C=C1

InChI

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