8-[(11-oxidanylidene-6H-benzo[c][1]benzoxepin-2-yl)oxy]octanoic acid

Systemtic Name: 8-[(11-oxidanylidene-6H-benzo[c][1]benzoxepin-2-yl)oxy]octanoic acid Openeye Name: 8-[(11-oxo-6H-benzo[c][1]benzoxepin-2-yl)oxy]octanoic acid CAS Name: 8-[(11-oxo-6H-benzo[c][1]benzoxepin-2-yl)oxy]octanoic acid IUPAC Name: 8-[(11-oxo-6H-benzo[c][1]benzoxepin-2-yl)oxy]octanoic acid Traditional Name: 8-[(11-keto-6H-benzo[c][1]benzoxepin-2-yl)oxy]caprylic acid Formula: C22H24O5 MolecularWeight: 368.42296

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)C3=C(O1)C=CC(=C3)OCCCCCCCC(=O)O

Isomeric SMILES

C1C2=CC=CC=C2C(=O)C3=C(O1)C=CC(=C3)OCCCCCCCC(=O)O

InChI

InChI=1S/C22H24O5/c23-21(24)10-4-2-1-3-7-13-26-17-11-12-20-19(14-17)22(25)18-9-6-5-8-16(18)15-27-20/h5-6,8-9,11-12,14H,1-4,7,10,13,15H2,(H,23,24)