4-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-6,8-dimethyl-chromen-2-one

Systemtic Name: 4-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-6,8-dimethyl-chromen-2-one Openeye Name: 4-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-6,8-dimethyl-chromen-2-one CAS Name: 4-[[4-(4-fluorophenyl)-1-piperazinyl]methyl]-6,8-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-6,8-dimethylchromen-2-one Traditional Name: 4-[[4-(4-fluorophenyl)piperazino]methyl]-6,8-dimethyl-coumarin Formula: C22H23FN2O2 MolecularWeight: 366.428623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=O)O2)CN3CCN(CC3)C4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=O)O2)CN3CCN(CC3)C4=CC=C(C=C4)F)C

InChI

InChI=1S/C22H23FN2O2/c1-15-11-16(2)22-20(12-15)17(13-21(26)27-22)14-24-7-9-25(10-8-24)19-5-3-18(23)4-6-19/h3-6,11-13H,7-10,14H2,1-2H3