ethyl 1-[2-(4-piperidin-1-ylsulfonylphenoxy)ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(4-piperidin-1-ylsulfonylphenoxy)ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[4-(1-piperidylsulfonyl)phenoxy]acetyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-[4-(1-piperidinylsulfonyl)phenoxy]ethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-piperidin-1-ylsulfonylphenoxy)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(4-piperidinosulfonylphenoxy)acetyl]isonipecotic acid ethyl ester Formula: C21H30N2O6S MolecularWeight: 438.5377

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)COC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)COC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H30N2O6S/c1-2-28-21(25)17-10-14-22(15-11-17)20(24)16-29-18-6-8-19(9-7-18)30(26,27)23-12-4-3-5-13-23/h6-9,17H,2-5,10-16H2,1H3