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

Systemtic Name: 7-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-2-methyl-chromen-4-one Openeye Name: 7-[(2-chloro-6-fluoro-phenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-2-methyl-chromen-4-one CAS Name: 7-[(2-chloro-6-fluorophenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-2-methyl-1-benzopyran-4-one IUPAC Name: 7-[(2-chloro-6-fluorophenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-2-methylchromen-4-one Traditional Name: 7-(2-chloro-6-fluoro-benzyl)oxy-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-2-methyl-chromone Formula: C28H24ClFO5 MolecularWeight: 494.938563

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCCCO4)OCC5=C(C=CC=C5Cl)F

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCCCO4)OCC5=C(C=CC=C5Cl)F

InChI

InChI=1S/C28H24ClFO5/c1-3-17-12-19-25(14-24(17)34-15-20-21(29)6-4-7-22(20)30)35-16(2)27(28(19)31)18-8-9-23-26(13-18)33-11-5-10-32-23/h4,6-9,12-14H,3,5,10-11,15H2,1-2H3