3-(3,4-dimethoxyphenyl)-6-[(2-fluorophenyl)methoxy]-4-methyl-chromen-2-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)-6-[(2-fluorophenyl)methoxy]-4-methyl-chromen-2-one Openeye Name: 3-(3,4-dimethoxyphenyl)-6-[(2-fluorophenyl)methoxy]-4-methyl-chromen-2-one CAS Name: 3-(3,4-dimethoxyphenyl)-6-[(2-fluorophenyl)methoxy]-4-methyl-1-benzopyran-2-one IUPAC Name: 3-(3,4-dimethoxyphenyl)-6-[(2-fluorophenyl)methoxy]-4-methylchromen-2-one Traditional Name: 3-(3,4-dimethoxyphenyl)-6-(2-fluorobenzyl)oxy-4-methyl-coumarin Formula: C25H21FO5 MolecularWeight: 420.429643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=C(C=C2)OCC3=CC=CC=C3F)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=C(C=C2)OCC3=CC=CC=C3F)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C25H21FO5/c1-15-19-13-18(30-14-17-6-4-5-7-20(17)26)9-11-21(19)31-25(27)24(15)16-8-10-22(28-2)23(12-16)29-3/h4-13H,14H2,1-3H3