methyl 3-[4-[2,6-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]carbonylbenzoate

Systemtic Name: methyl 3-[4-[2,6-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]carbonylbenzoate Openeye Name: methyl 3-[4-(2,6-difluorophenyl)sulfonylpiperazine-1-carbonyl]benzoate CAS Name: 3-[[4-(2,6-difluorophenyl)sulfonyl-1-piperazinyl]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[4-(2,6-difluorophenyl)sulfonylpiperazine-1-carbonyl]benzoate Traditional Name: 3-[4-(2,6-difluorophenyl)sulfonylpiperazine-1-carbonyl]benzoic acid methyl ester Formula: C19H18F2N2O5S MolecularWeight: 424.418426

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC=C3F)F

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC=C3F)F

InChI

InChI=1S/C19H18F2N2O5S/c1-28-19(25)14-5-2-4-13(12-14)18(24)22-8-10-23(11-9-22)29(26,27)17-15(20)6-3-7-16(17)21/h2-7,12H,8-11H2,1H3