7-bromanyl-4-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]chromen-2-one

Systemtic Name: 7-bromanyl-4-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]chromen-2-one Openeye Name: 7-bromo-4-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]chromen-2-one CAS Name: 7-bromo-4-[[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 7-bromo-4-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]chromen-2-one Traditional Name: 7-bromo-4-[[4-(3-fluorophenyl)sulfonylpiperazino]methyl]coumarin Formula: C20H18BrFN2O4S MolecularWeight: 481.335323

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=O)OC3=C2C=CC(=C3)Br)S(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

C1CN(CCN1CC2=CC(=O)OC3=C2C=CC(=C3)Br)S(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C20H18BrFN2O4S/c21-15-4-5-18-14(10-20(25)28-19(18)11-15)13-23-6-8-24(9-7-23)29(26,27)17-3-1-2-16(22)12-17/h1-5,10-12H,6-9,13H2