bis[(2S)-3-(tert-butylamino)-2-oxidanyl-propyl] benzene-1,4-dicarboxylate

Systemtic Name: bis[(2S)-3-(tert-butylamino)-2-oxidanyl-propyl] benzene-1,4-dicarboxylate Openeye Name: bis[(2S)-3-(tert-butylamino)-2-hydroxy-propyl] benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid bis[(2S)-3-(tert-butylamino)-2-hydroxypropyl] ester IUPAC Name: bis[(2S)-3-(tert-butylamino)-2-hydroxypropyl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid bis[(2S)-3-(tert-butylamino)-2-hydroxy-propyl] ester Formula: C22H36N2O6 MolecularWeight: 424.53104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC(=O)C1=CC=C(C=C1)C(=O)OCC(CNC(C)(C)C)O)O

Isomeric SMILES

CC(C)(C)NC[C@@H](COC(=O)C1=CC=C(C=C1)C(=O)OC[C@H](CNC(C)(C)C)O)O

InChI

InChI=1S/C22H36N2O6/c1-21(2,3)23-11-17(25)13-29-19(27)15-7-9-16(10-8-15)20(28)30-14-18(26)12-24-22(4,5)6/h7-10,17-18,23-26H,11-14H2,1-6H3/t17-,18-/m0/s1