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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCCO4)OCC5=C(C=C(C=C5)F)Cl

Isomeric SMILES

CCCC1=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/C28H24ClFO5/c1-2-4-18-11-21-26(14-25(18)34-15-19-5-7-20(30)13-23(19)29)35-16-22(28(21)31)17-6-8-24-27(12-17)33-10-3-9-32-24/h5-8,11-14,16H,2-4,9-10,15H2,1H3