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

Systemtic Name: 7-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-chromen-4-one Openeye Name: 7-[(2-chloro-4-fluoro-phenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-chromen-4-one CAS Name: 7-[(2-chloro-4-fluorophenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-1-benzopyran-4-one IUPAC Name: 7-[(2-chloro-4-fluorophenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethylchromen-4-one Traditional Name: 7-(2-chloro-4-fluoro-benzyl)oxy-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-chromone Formula: C27H22ClFO5 MolecularWeight: 480.911983

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCCO4)OCC5=C(C=C(C=C5)F)Cl

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCCO4)OCC5=C(C=C(C=C5)F)Cl

InChI

InChI=1S/C27H22ClFO5/c1-2-16-10-20-25(13-24(16)33-14-18-4-6-19(29)12-22(18)28)34-15-21(27(20)30)17-5-7-23-26(11-17)32-9-3-8-31-23/h4-7,10-13,15H,2-3,8-9,14H2,1H3