(2-aminocarbonyl-5-methoxy-phenyl) 1-(2-fluorophenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (2-aminocarbonyl-5-methoxy-phenyl) 1-(2-fluorophenyl)sulfonylpiperidine-4-carboxylate Openeye Name: (2-carbamoyl-5-methoxy-phenyl) 1-(2-fluorophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(2-fluorophenyl)sulfonyl-4-piperidinecarboxylic acid (2-carbamoyl-5-methoxyphenyl) ester IUPAC Name: (2-carbamoyl-5-methoxyphenyl) 1-(2-fluorophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-fluorophenyl)sulfonylisonipecotic acid (2-carbamoyl-5-methoxy-phenyl) ester Formula: C20H21FN2O6S MolecularWeight: 436.453943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)N)OC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)N)OC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C20H21FN2O6S/c1-28-14-6-7-15(19(22)24)17(12-14)29-20(25)13-8-10-23(11-9-13)30(26,27)18-5-3-2-4-16(18)21/h2-7,12-13H,8-11H2,1H3,(H2,22,24)