(4-chloranyl-3-methyl-phenyl) 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (4-chloranyl-3-methyl-phenyl) 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate Openeye Name: (4-chloro-3-methyl-phenyl) 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxylic acid (4-chloro-3-methylphenyl) ester IUPAC Name: (4-chloro-3-methylphenyl) 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(4-fluorophenyl)sulfonylisonipecotic acid (4-chloro-3-methyl-phenyl) ester Formula: C19H19ClFNO4S MolecularWeight: 411.874863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C19H19ClFNO4S/c1-13-12-16(4-7-18(13)20)26-19(23)14-8-10-22(11-9-14)27(24,25)17-5-2-15(21)3-6-17/h2-7,12,14H,8-11H2,1H3