4-[[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methyl]-7-methoxy-chromen-2-one

Systemtic Name: 4-[[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methyl]-7-methoxy-chromen-2-one Openeye Name: 4-[[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]methyl]-7-methoxy-chromen-2-one CAS Name: 4-[[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]methyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]methyl]-7-methoxychromen-2-one Traditional Name: 4-[[4-(3-fluoro-4-methoxy-benzyl)piperazino]methyl]-7-methoxy-coumarin Formula: C23H25FN2O4 MolecularWeight: 412.454003

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)CC4=CC(=C(C=C4)OC)F

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)CC4=CC(=C(C=C4)OC)F

InChI

InChI=1S/C23H25FN2O4/c1-28-18-4-5-19-17(12-23(27)30-22(19)13-18)15-26-9-7-25(8-10-26)14-16-3-6-21(29-2)20(24)11-16/h3-6,11-13H,7-10,14-15H2,1-2H3