4-phenylbutyl 1-(4-fluorophenyl)sulfonylpiperidine-2-carboxylate

Systemtic Name: 4-phenylbutyl 1-(4-fluorophenyl)sulfonylpiperidine-2-carboxylate Openeye Name: 4-phenylbutyl 1-(4-fluorophenyl)sulfonylpiperidine-2-carboxylate CAS Name: 1-(4-fluorophenyl)sulfonyl-2-piperidinecarboxylic acid 4-phenylbutyl ester IUPAC Name: 4-phenylbutyl 1-(4-fluorophenyl)sulfonylpiperidine-2-carboxylate Traditional Name: 1-(4-fluorophenyl)sulfonylpipecolinic acid 4-phenylbutyl ester Formula: C22H26FNO4S MolecularWeight: 419.509543

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)OCCCCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CCN(C(C1)C(=O)OCCCCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FNO4S/c23-19-12-14-20(15-13-19)29(26,27)24-16-6-4-11-21(24)22(25)28-17-7-5-10-18-8-2-1-3-9-18/h1-3,8-9,12-15,21H,4-7,10-11,16-17H2