(3-chloranyl-4-fluoranyl-phenyl) 4-methyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (3-chloranyl-4-fluoranyl-phenyl) 4-methyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: (3-chloro-4-fluoro-phenyl) 4-methyl-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-methyl-3-(1-piperidinylsulfonyl)benzoic acid (3-chloro-4-fluorophenyl) ester IUPAC Name: (3-chloro-4-fluorophenyl) 4-methyl-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-methyl-3-piperidinosulfonyl-benzoic acid (3-chloro-4-fluoro-phenyl) ester Formula: C19H19ClFNO4S MolecularWeight: 411.874863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2=CC(=C(C=C2)F)Cl)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2=CC(=C(C=C2)F)Cl)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H19ClFNO4S/c1-13-5-6-14(19(23)26-15-7-8-17(21)16(20)12-15)11-18(13)27(24,25)22-9-3-2-4-10-22/h5-8,11-12H,2-4,9-10H2,1H3