tert-butyl 4-[3-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoyl]piperazine-1-carboxylate CAS Name: 4-[[3-[(2,6-dimethyl-4-morpholinyl)sulfonyl]phenyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(2,6-dimethylmorpholino)sulfonylbenzoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C22H33N3O6S MolecularWeight: 467.57892

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H33N3O6S/c1-16-14-25(15-17(2)30-16)32(28,29)19-8-6-7-18(13-19)20(26)23-9-11-24(12-10-23)21(27)31-22(3,4)5/h6-8,13,16-17H,9-12,14-15H2,1-5H3