7-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-chromen-4-one

Systemtic Name: 7-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-chromen-4-one Openeye Name: 7-[(2-chloro-6-fluoro-phenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-chromen-4-one CAS Name: 7-[(2-chloro-6-fluorophenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-benzopyran-4-one IUPAC Name: 7-[(2-chloro-6-fluorophenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylchromen-4-one Traditional Name: 7-(2-chloro-6-fluoro-benzyl)oxy-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-chromone Formula: C26H20ClFO5 MolecularWeight: 466.885403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC3=C(C=CC=C3Cl)F)C4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC3=C(C=CC=C3Cl)F)C4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C26H20ClFO5/c1-15-25(16-6-9-22-24(12-16)31-11-3-10-30-22)26(29)18-8-7-17(13-23(18)33-15)32-14-19-20(27)4-2-5-21(19)28/h2,4-9,12-13H,3,10-11,14H2,1H3