2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 5-(dimethylsulfamoyl)-2-piperidin-1-yl-benzoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 5-(dimethylsulfamoyl)-2-piperidin-1-yl-benzoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 5-(dimethylsulfamoyl)-2-(1-piperidyl)benzoate CAS Name: 5-(dimethylsulfamoyl)-2-(1-piperidinyl)benzoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 5-(dimethylsulfamoyl)-2-piperidin-1-ylbenzoate Traditional Name: 5-(dimethylsulfamoyl)-2-piperidino-benzoic acid 2-phthalimidoethyl ester Formula: C24H27N3O6S MolecularWeight: 485.55268

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)C(=O)OCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)C(=O)OCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H27N3O6S/c1-25(2)34(31,32)17-10-11-21(26-12-6-3-7-13-26)20(16-17)24(30)33-15-14-27-22(28)18-8-4-5-9-19(18)23(27)29/h4-5,8-11,16H,3,6-7,12-15H2,1-2H3