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

Systemtic Name: (2-chloranyl-4-nitro-phenyl) 4-fluoranyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: (2-chloro-4-nitro-phenyl) 4-fluoro-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-fluoro-3-(1-piperidinylsulfonyl)benzoic acid (2-chloro-4-nitrophenyl) ester IUPAC Name: (2-chloro-4-nitrophenyl) 4-fluoro-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-fluoro-3-piperidinosulfonyl-benzoic acid (2-chloro-4-nitro-phenyl) ester Formula: C18H16ClFN2O6S MolecularWeight: 442.845843

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl)F

InChI

InChI=1S/C18H16ClFN2O6S/c19-14-11-13(22(24)25)5-7-16(14)28-18(23)12-4-6-15(20)17(10-12)29(26,27)21-8-2-1-3-9-21/h4-7,10-11H,1-3,8-9H2