7-[(2-chloranyl-4-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-4-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-4-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-4-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-4-fluorophenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-2-methylchromen-4-one Traditional Name: 7-(2-chloro-4-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=C(C=C5)F)Cl

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCCCO4)OCC5=C(C=C(C=C5)F)Cl

InChI

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