ethyl 1-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[4-chloro-3-(1-piperidylsulfonyl)benzoyl]piperidine-4-carboxylate CAS Name: 1-[[4-chloro-3-(1-piperidinylsulfonyl)phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-chloro-3-piperidin-1-ylsulfonylbenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-chloro-3-piperidinosulfonyl-benzoyl)isonipecotic acid ethyl ester Formula: C20H27ClN2O5S MolecularWeight: 442.95678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27ClN2O5S/c1-2-28-20(25)15-8-12-22(13-9-15)19(24)16-6-7-17(21)18(14-16)29(26,27)23-10-4-3-5-11-23/h6-7,14-15H,2-5,8-13H2,1H3