2-phenoxyethyl 4-fluoranyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: 2-phenoxyethyl 4-fluoranyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: 2-phenoxyethyl 4-fluoro-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-fluoro-3-(1-piperidinylsulfonyl)benzoic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 4-fluoro-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-fluoro-3-piperidinosulfonyl-benzoic acid 2-phenoxyethyl ester Formula: C20H22FNO5S MolecularWeight: 407.455783

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCCOC3=CC=CC=C3)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCCOC3=CC=CC=C3)F

InChI

InChI=1S/C20H22FNO5S/c21-18-10-9-16(15-19(18)28(24,25)22-11-5-2-6-12-22)20(23)27-14-13-26-17-7-3-1-4-8-17/h1,3-4,7-10,15H,2,5-6,11-14H2