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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCO4)OCC5=C(C=C(C=C5)F)Cl

Isomeric SMILES

CCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCO4)OCC5=C(C=C(C=C5)F)Cl

InChI

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