ethyl 1-[2-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonyloxyethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonyloxyethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[4-chloro-3-(1-piperidylsulfonyl)benzoyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[[4-chloro-3-(1-piperidinylsulfonyl)phenyl]-oxomethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-chloro-3-piperidin-1-ylsulfonylbenzoyl)oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(4-chloro-3-piperidinosulfonyl-benzoyl)oxyacetyl]isonipecotic acid ethyl ester Formula: C22H29ClN2O7S MolecularWeight: 500.99286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29ClN2O7S/c1-2-31-21(27)16-8-12-24(13-9-16)20(26)15-32-22(28)17-6-7-18(23)19(14-17)33(29,30)25-10-4-3-5-11-25/h6-7,14,16H,2-5,8-13,15H2,1H3