[2-(2-chlorophenyl)-2-oxidanylidene-ethyl] 2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: [2-(2-chlorophenyl)-2-oxidanylidene-ethyl] 2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: [2-(2-chlorophenyl)-2-oxo-ethyl] 2-morpholino-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-(4-morpholinyl)-5-(1-piperidinylsulfonyl)benzoic acid [2-(2-chlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2-chlorophenyl)-2-oxoethyl] 2-morpholin-4-yl-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-morpholino-5-piperidinosulfonyl-benzoic acid [2-(2-chlorophenyl)-2-keto-ethyl] ester Formula: C24H27ClN2O6S MolecularWeight: 506.99898

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCOCC3)C(=O)OCC(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCOCC3)C(=O)OCC(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C24H27ClN2O6S/c25-21-7-3-2-6-19(21)23(28)17-33-24(29)20-16-18(34(30,31)27-10-4-1-5-11-27)8-9-22(20)26-12-14-32-15-13-26/h2-3,6-9,16H,1,4-5,10-15,17H2