tris(phenylmethyl) (3S)-3-[(triphenylmethyl)amino]propane-1,1,3-tricarboxylate

Systemtic Name: tris(phenylmethyl) (3S)-3-[(triphenylmethyl)amino]propane-1,1,3-tricarboxylate Openeye Name: tribenzyl (3S)-3-(tritylamino)propane-1,1,3-tricarboxylate CAS Name: (3S)-3-[(triphenylmethyl)amino]propane-1,1,3-tricarboxylic acid tris(phenylmethyl) ester IUPAC Name: tribenzyl (3S)-3-(tritylamino)propane-1,1,3-tricarboxylate Traditional Name: (3S)-3-(tritylamino)propane-1,1,3-tricarboxylic acid tribenzyl ester Formula: C46H41NO6 MolecularWeight: 703.82084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CC(C(=O)OCC2=CC=CC=C2)NC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)OCC6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)[C@H](CC(C(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)NC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C46H41NO6/c48-43(51-32-35-19-7-1-8-20-35)41(44(49)52-33-36-21-9-2-10-22-36)31-42(45(50)53-34-37-23-11-3-12-24-37)47-46(38-25-13-4-14-26-38,39-27-15-5-16-28-39)40-29-17-6-18-30-40/h1-30,41-42,47H,31-34H2/t42-/m0/s1