ethyl 1-[2-(3-piperidin-1-ylsulfonylphenyl)carbonyloxyethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(3-piperidin-1-ylsulfonylphenyl)carbonyloxyethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[3-(1-piperidylsulfonyl)benzoyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-[oxo-[3-(1-piperidinylsulfonyl)phenyl]methoxy]ethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3-piperidin-1-ylsulfonylbenzoyl)oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(3-piperidinosulfonylbenzoyl)oxyacetyl]isonipecotic acid ethyl ester Formula: C22H30N2O7S MolecularWeight: 466.5478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N2O7S/c1-2-30-21(26)17-9-13-23(14-10-17)20(25)16-31-22(27)18-7-6-8-19(15-18)32(28,29)24-11-4-3-5-12-24/h6-8,15,17H,2-5,9-14,16H2,1H3