2,4-bis(11-oxidanylidene-6H-benzo[c][1]benzoxepin-2-yl)butanoic acid

Systemtic Name: 2,4-bis(11-oxidanylidene-6H-benzo[c][1]benzoxepin-2-yl)butanoic acid Openeye Name: 2,4-bis(11-oxo-6H-benzo[c][1]benzoxepin-2-yl)butanoic acid CAS Name: 2,4-bis(11-oxo-6H-benzo[c][1]benzoxepin-2-yl)butanoic acid IUPAC Name: 2,4-bis(11-oxo-6H-benzo[c][1]benzoxepin-2-yl)butanoic acid Traditional Name: 2,4-bis(11-keto-6H-benzo[c][1]benzoxepin-2-yl)butyric acid Formula: C32H24O6 MolecularWeight: 504.52936

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)C3=C(O1)C=CC(=C3)CCC(C4=CC5=C(C=C4)OCC6=CC=CC=C6C5=O)C(=O)O

Isomeric SMILES

C1C2=CC=CC=C2C(=O)C3=C(O1)C=CC(=C3)CCC(C4=CC5=C(C=C4)OCC6=CC=CC=C6C5=O)C(=O)O

InChI

InChI=1S/C32H24O6/c33-30-23-7-3-1-5-21(23)17-37-28-13-10-19(15-26(28)30)9-12-25(32(35)36)20-11-14-29-27(16-20)31(34)24-8-4-2-6-22(24)18-38-29/h1-8,10-11,13-16,25H,9,12,17-18H2,(H,35,36)