6-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]-2-oxidanylidene-ethoxy]-4-methyl-chromen-2-one

Systemtic Name: 6-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]-2-oxidanylidene-ethoxy]-4-methyl-chromen-2-one Openeye Name: 6-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]-2-oxo-ethoxy]-4-methyl-chromen-2-one CAS Name: 6-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-1-piperazinyl]-2-oxoethoxy]-4-methyl-1-benzopyran-2-one IUPAC Name: 6-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethylpiperazin-1-yl]-2-oxoethoxy]-4-methylchromen-2-one Traditional Name: 6-[2-[4-(4-fluorobenzyl)-2,5-dimethyl-piperazino]-2-keto-ethoxy]-4-methyl-coumarin Formula: C25H27FN2O4 MolecularWeight: 438.491283

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1C(=O)COC2=CC3=C(C=C2)OC(=O)C=C3C)C)CC4=CC=C(C=C4)F

Isomeric SMILES

CC1CN(C(CN1C(=O)COC2=CC3=C(C=C2)OC(=O)C=C3C)C)CC4=CC=C(C=C4)F

InChI

InChI=1S/C25H27FN2O4/c1-16-10-25(30)32-23-9-8-21(11-22(16)23)31-15-24(29)28-13-17(2)27(12-18(28)3)14-19-4-6-20(26)7-5-19/h4-11,17-18H,12-15H2,1-3H3