2-(4-cyanophenoxy)ethyl 1-(phenylsulfonyl)piperidine-2-carboxylate

Systemtic Name: 2-(4-cyanophenoxy)ethyl 1-(phenylsulfonyl)piperidine-2-carboxylate Openeye Name: 2-(4-cyanophenoxy)ethyl 1-(benzenesulfonyl)piperidine-2-carboxylate CAS Name: 1-(benzenesulfonyl)-2-piperidinecarboxylic acid 2-(4-cyanophenoxy)ethyl ester IUPAC Name: 2-(4-cyanophenoxy)ethyl 1-(benzenesulfonyl)piperidine-2-carboxylate Traditional Name: 1-besylpipecolinic acid 2-(4-cyanophenoxy)ethyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)OCCOC2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C(C1)C(=O)OCCOC2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O5S/c22-16-17-9-11-18(12-10-17)27-14-15-28-21(24)20-8-4-5-13-23(20)29(25,26)19-6-2-1-3-7-19/h1-3,6-7,9-12,20H,4-5,8,13-15H2