2-[4-[(E)-(7-fluoranyl-5-oxidanylidene-2,3-dihydro-1-benzoxepin-4-ylidene)methyl]-2-methoxy-phenoxy]ethanoate

Systemtic Name: 2-[4-[(E)-(7-fluoranyl-5-oxidanylidene-2,3-dihydro-1-benzoxepin-4-ylidene)methyl]-2-methoxy-phenoxy]ethanoate Openeye Name: 2-[4-[(E)-(7-fluoro-5-oxo-2,3-dihydro-1-benzoxepin-4-ylidene)methyl]-2-methoxy-phenoxy]acetate CAS Name: 2-[4-[(E)-(7-fluoro-5-oxo-2,3-dihydro-1-benzoxepin-4-ylidene)methyl]-2-methoxyphenoxy]acetate IUPAC Name: 2-[4-[(E)-(7-fluoro-5-oxo-2,3-dihydro-1-benzoxepin-4-ylidene)methyl]-2-methoxyphenoxy]acetate Traditional Name: 2-[4-[(E)-(7-fluoro-5-keto-2,3-dihydro-1-benzoxepin-4-ylidene)methyl]-2-methoxy-phenoxy]acetate Formula: C20H16FO6- MolecularWeight: 371.335843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2CCOC3=C(C2=O)C=C(C=C3)F)OCC(=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/2\CCOC3=C(C2=O)C=C(C=C3)F)OCC(=O)[O-]

InChI

InChI=1S/C20H17FO6/c1-25-18-9-12(2-4-17(18)27-11-19(22)23)8-13-6-7-26-16-5-3-14(21)10-15(16)20(13)24/h2-5,8-10H,6-7,11H2,1H3,(H,22,23)/p-1/b13-8+