triethyl (3R,5R)-4,5-diphenyl-1,2,4-triazolidine-1,2,3-tricarboxylate

Systemtic Name: triethyl (3R,5R)-4,5-diphenyl-1,2,4-triazolidine-1,2,3-tricarboxylate Openeye Name: triethyl (3R,5R)-4,5-diphenyl-1,2,4-triazolidine-1,2,3-tricarboxylate CAS Name: (3R,5R)-4,5-diphenyl-1,2,4-triazolidine-1,2,3-tricarboxylic acid triethyl ester IUPAC Name: triethyl (3R,5R)-4,5-diphenyl-1,2,4-triazolidine-1,2,3-tricarboxylate Traditional Name: (3R,5R)-4,5-diphenyl-1,2,4-triazolidine-1,2,3-tricarboxylic acid triethyl ester Formula: C23H27N3O6 MolecularWeight: 441.47698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1N(C(N(N1C(=O)OCC)C(=O)OCC)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@H]1N([C@H](N(N1C(=O)OCC)C(=O)OCC)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H27N3O6/c1-4-30-21(27)20-24(18-15-11-8-12-16-18)19(17-13-9-7-10-14-17)25(22(28)31-5-2)26(20)23(29)32-6-3/h7-16,19-20H,4-6H2,1-3H3/t19-,20-/m1/s1