5-tert-butyl-3-[[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]methyl]benzene-1,2-diol

Systemtic Name: 5-tert-butyl-3-[[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]methyl]benzene-1,2-diol Openeye Name: 5-tert-butyl-3-[[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]methyl]benzene-1,2-diol CAS Name: 5-tert-butyl-3-[[4-[(2,6-dimethyl-4-morpholinyl)sulfonyl]-1-piperazinyl]methyl]benzene-1,2-diol IUPAC Name: 5-tert-butyl-3-[[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]methyl]benzene-1,2-diol Traditional Name: 5-tert-butyl-3-[[4-(2,6-dimethylmorpholino)sulfonylpiperazino]methyl]pyrocatechol Formula: C21H35N3O5S MolecularWeight: 441.5847

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)N2CCN(CC2)CC3=C(C(=CC(=C3)C(C)(C)C)O)O

Isomeric SMILES

CC1CN(CC(O1)C)S(=O)(=O)N2CCN(CC2)CC3=C(C(=CC(=C3)C(C)(C)C)O)O

InChI

InChI=1S/C21H35N3O5S/c1-15-12-24(13-16(2)29-15)30(27,28)23-8-6-22(7-9-23)14-17-10-18(21(3,4)5)11-19(25)20(17)26/h10-11,15-16,25-26H,6-9,12-14H2,1-5H3