2-(4-propoxyphenoxy)ethyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: 2-(4-propoxyphenoxy)ethyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate Openeye Name: 2-(4-propoxyphenoxy)ethyl 1-(3-pyridylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(3-pyridinylsulfonyl)-4-piperidinecarboxylic acid 2-(4-propoxyphenoxy)ethyl ester IUPAC Name: 2-(4-propoxyphenoxy)ethyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(3-pyridylsulfonyl)isonipecotic acid 2-(4-propoxyphenoxy)ethyl ester Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)OCCOC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CCCOC1=CC=C(C=C1)OCCOC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C22H28N2O6S/c1-2-14-28-19-5-7-20(8-6-19)29-15-16-30-22(25)18-9-12-24(13-10-18)31(26,27)21-4-3-11-23-17-21/h3-8,11,17-18H,2,9-10,12-16H2,1H3