1-[3-[(4-chloranyl-2-fluoranyl-phenyl)carbamoyl]-4-fluoranyl-phenyl]sulfonylpiperidine-4-carboxylate

Systemtic Name: 1-[3-[(4-chloranyl-2-fluoranyl-phenyl)carbamoyl]-4-fluoranyl-phenyl]sulfonylpiperidine-4-carboxylate Openeye Name: 1-[3-[(4-chloro-2-fluoro-phenyl)carbamoyl]-4-fluoro-phenyl]sulfonylpiperidine-4-carboxylate CAS Name: 1-[3-[(4-chloro-2-fluoroanilino)-oxomethyl]-4-fluorophenyl]sulfonyl-4-piperidinecarboxylate IUPAC Name: 1-[3-[(4-chloro-2-fluorophenyl)carbamoyl]-4-fluorophenyl]sulfonylpiperidine-4-carboxylate Traditional Name: 1-[3-[(4-chloro-2-fluoro-phenyl)carbamoyl]-4-fluoro-phenyl]sulfonylisonipecotate Formula: C19H16ClF2N2O5S- MolecularWeight: 457.855546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)[O-])S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)NC3=C(C=C(C=C3)Cl)F

Isomeric SMILES

C1CN(CCC1C(=O)[O-])S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)NC3=C(C=C(C=C3)Cl)F

InChI

InChI=1S/C19H17ClF2N2O5S/c20-12-1-4-17(16(22)9-12)23-18(25)14-10-13(2-3-15(14)21)30(28,29)24-7-5-11(6-8-24)19(26)27/h1-4,9-11H,5-8H2,(H,23,25)(H,26,27)/p-1