7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanyl-propoxy]-3-(4-fluorophenyl)chromen-4-one

Systemtic Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanyl-propoxy]-3-(4-fluorophenyl)chromen-4-one Openeye Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxy-propoxy]-3-(4-fluorophenyl)chromen-4-one CAS Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]-3-(4-fluorophenyl)-1-benzopyran-4-one IUPAC Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]-3-(4-fluorophenyl)chromen-4-one Traditional Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxy-propoxy]-3-(4-fluorophenyl)chromone Formula: C27H24FNO4 MolecularWeight: 445.482163

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC(COC3=CC4=C(C=C3)C(=O)C(=CO4)C5=CC=C(C=C5)F)O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC(COC3=CC4=C(C=C3)C(=O)C(=CO4)C5=CC=C(C=C5)F)O

InChI

InChI=1S/C27H24FNO4/c28-21-7-5-19(6-8-21)25-17-33-26-13-23(9-10-24(26)27(25)31)32-16-22(30)15-29-12-11-18-3-1-2-4-20(18)14-29/h1-10,13,17,22,30H,11-12,14-16H2