2-(4-fluoranylphenoxy)ethyl 1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: 2-(4-fluoranylphenoxy)ethyl 1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: 2-(4-fluorophenoxy)ethyl 1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-4-piperidinecarboxylic acid 2-(4-fluorophenoxy)ethyl ester IUPAC Name: 2-(4-fluorophenoxy)ethyl 1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(3,4-dimethylphenyl)sulfonylisonipecotic acid 2-(4-fluorophenoxy)ethyl ester Formula: C22H26FNO5S MolecularWeight: 435.508943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCCOC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCCOC3=CC=C(C=C3)F)C

InChI

InChI=1S/C22H26FNO5S/c1-16-3-8-21(15-17(16)2)30(26,27)24-11-9-18(10-12-24)22(25)29-14-13-28-20-6-4-19(23)5-7-20/h3-8,15,18H,9-14H2,1-2H3