6-bromanyl-3-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-8-methoxy-chromen-2-one

Systemtic Name: 6-bromanyl-3-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-8-methoxy-chromen-2-one Openeye Name: 6-bromo-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-8-methoxy-chromen-2-one CAS Name: 6-bromo-3-[[4-(4-fluorophenyl)-1-piperazinyl]-oxomethyl]-8-methoxy-1-benzopyran-2-one IUPAC Name: 6-bromo-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-8-methoxychromen-2-one Traditional Name: 6-bromo-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-8-methoxy-coumarin Formula: C21H18BrFN2O4 MolecularWeight: 461.281023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)Br)C=C(C(=O)O2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=C2C(=CC(=C1)Br)C=C(C(=O)O2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H18BrFN2O4/c1-28-18-12-14(22)10-13-11-17(21(27)29-19(13)18)20(26)25-8-6-24(7-9-25)16-4-2-15(23)3-5-16/h2-5,10-12H,6-9H2,1H3