tris[[(1R)-2-oxidanyl-1-phenyl-ethyl]amino] 1,3,5-trimethylcyclohexane-1,3,5-tricarboxylate

Systemtic Name: tris[[(1R)-2-oxidanyl-1-phenyl-ethyl]amino] 1,3,5-trimethylcyclohexane-1,3,5-tricarboxylate Openeye Name: tris[[(1R)-2-hydroxy-1-phenyl-ethyl]amino] 1,3,5-trimethylcyclohexane-1,3,5-tricarboxylate CAS Name: 1,3,5-trimethylcyclohexane-1,3,5-tricarboxylic acid tris[[(1R)-2-hydroxy-1-phenylethyl]amino] ester IUPAC Name: tris[[(1R)-2-hydroxy-1-phenylethyl]amino] 1,3,5-trimethylcyclohexane-1,3,5-tricarboxylate Traditional Name: 1,3,5-trimethylcyclohexane-1,3,5-tricarboxylic acid tris[[(1R)-2-hydroxy-1-phenyl-ethyl]amino] ester Formula: C36H45N3O9 MolecularWeight: 663.7572

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1)(C)C(=O)ONC(CO)C2=CC=CC=C2)(C)C(=O)ONC(CO)C3=CC=CC=C3)C(=O)ONC(CO)C4=CC=CC=C4

Isomeric SMILES

CC1(CC(CC(C1)(C)C(=O)ON[C@@H](CO)C2=CC=CC=C2)(C)C(=O)ON[C@@H](CO)C3=CC=CC=C3)C(=O)ON[C@@H](CO)C4=CC=CC=C4

InChI

InChI=1S/C36H45N3O9/c1-34(31(43)46-37-28(19-40)25-13-7-4-8-14-25)22-35(2,32(44)47-38-29(20-41)26-15-9-5-10-16-26)24-36(3,23-34)33(45)48-39-30(21-42)27-17-11-6-12-18-27/h4-18,28-30,37-42H,19-24H2,1-3H3/t28-,29-,30-,34?,35?,36?/m0/s1