(2-naphthalen-2-yl-2-oxidanylidene-ethyl) 4-fluoranyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (2-naphthalen-2-yl-2-oxidanylidene-ethyl) 4-fluoranyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: [2-(2-naphthyl)-2-oxo-ethyl] 4-fluoro-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-fluoro-3-(1-piperidinylsulfonyl)benzoic acid [2-(2-naphthalenyl)-2-oxoethyl] ester IUPAC Name: (2-naphthalen-2-yl-2-oxoethyl) 4-fluoro-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-fluoro-3-piperidinosulfonyl-benzoic acid [2-keto-2-(2-naphthyl)ethyl] ester Formula: C24H22FNO5S MolecularWeight: 455.498583

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)C3=CC4=CC=CC=C4C=C3)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)C3=CC4=CC=CC=C4C=C3)F

InChI

InChI=1S/C24H22FNO5S/c25-21-11-10-20(15-23(21)32(29,30)26-12-4-1-5-13-26)24(28)31-16-22(27)19-9-8-17-6-2-3-7-18(17)14-19/h2-3,6-11,14-15H,1,4-5,12-13,16H2