tris[[(2S)-1-oxidanylpropan-2-yl]amino] 1,3,5-trimethylcyclohexane-1,3,5-tricarboxylate

Systemtic Name: tris[[(2S)-1-oxidanylpropan-2-yl]amino] 1,3,5-trimethylcyclohexane-1,3,5-tricarboxylate Openeye Name: tris[[(1S)-2-hydroxy-1-methyl-ethyl]amino] 1,3,5-trimethylcyclohexane-1,3,5-tricarboxylate CAS Name: 1,3,5-trimethylcyclohexane-1,3,5-tricarboxylic acid tris[[(2S)-1-hydroxypropan-2-yl]amino] ester IUPAC Name: tris[[(2S)-1-hydroxypropan-2-yl]amino] 1,3,5-trimethylcyclohexane-1,3,5-tricarboxylate Traditional Name: 1,3,5-trimethylcyclohexane-1,3,5-tricarboxylic acid tris[[(1S)-2-hydroxy-1-methyl-ethyl]amino] ester Formula: C21H39N3O9 MolecularWeight: 477.54906

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)NOC(=O)C1(CC(CC(C1)(C)C(=O)ONC(C)CO)(C)C(=O)ONC(C)CO)C

Isomeric SMILES

C[C@@H](CO)NOC(=O)C1(CC(CC(C1)(C)C(=O)ON[C@@H](C)CO)(C)C(=O)ON[C@@H](C)CO)C

InChI

InChI=1S/C21H39N3O9/c1-13(7-25)22-31-16(28)19(4)10-20(5,17(29)32-23-14(2)8-26)12-21(6,11-19)18(30)33-24-15(3)9-27/h13-15,22-27H,7-12H2,1-6H3/t13-,14-,15-,19?,20?,21?/m0/s1