(2-oxidanylidene-2-propan-2-yloxy-ethyl) 4-piperidin-1-yl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (2-oxidanylidene-2-propan-2-yloxy-ethyl) 4-piperidin-1-yl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: (2-isopropoxy-2-oxo-ethyl) 4-(1-piperidyl)-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-(1-piperidinyl)-3-(1-piperidinylsulfonyl)benzoic acid (2-oxo-2-propan-2-yloxyethyl) ester IUPAC Name: (2-oxo-2-propan-2-yloxyethyl) 4-piperidin-1-yl-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-piperidino-3-piperidinosulfonyl-benzoic acid (2-isopropoxy-2-keto-ethyl) ester Formula: C22H32N2O6S MolecularWeight: 452.56428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)COC(=O)C1=CC(=C(C=C1)N2CCCCC2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)OC(=O)COC(=O)C1=CC(=C(C=C1)N2CCCCC2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H32N2O6S/c1-17(2)30-21(25)16-29-22(26)18-9-10-19(23-11-5-3-6-12-23)20(15-18)31(27,28)24-13-7-4-8-14-24/h9-10,15,17H,3-8,11-14,16H2,1-2H3