tritert-butyl 4-oxidanyl-5-oxidanylidene-3,4-diphenyl-pyrazolidine-1,2,3-tricarboxylate

Systemtic Name: tritert-butyl 4-oxidanyl-5-oxidanylidene-3,4-diphenyl-pyrazolidine-1,2,3-tricarboxylate Openeye Name: tritert-butyl 4-hydroxy-5-oxo-3,4-diphenyl-pyrazolidine-1,2,3-tricarboxylate CAS Name: 4-hydroxy-5-oxo-3,4-diphenylpyrazolidine-1,2,3-tricarboxylic acid tritert-butyl ester IUPAC Name: tritert-butyl 4-hydroxy-5-oxo-3,4-diphenylpyrazolidine-1,2,3-tricarboxylate Traditional Name: 4-hydroxy-5-keto-3,4-diphenyl-pyrazolidine-1,2,3-tricarboxylic acid tritert-butyl ester Formula: C30H38N2O8 MolecularWeight: 554.63132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1(C(C(=O)N(N1C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)(C2=CC=CC=C2)O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)C1(C(C(=O)N(N1C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)(C2=CC=CC=C2)O)C3=CC=CC=C3

InChI

InChI=1S/C30H38N2O8/c1-26(2,3)38-23(34)29(20-16-12-10-13-17-20)30(37,21-18-14-11-15-19-21)22(33)31(24(35)39-27(4,5)6)32(29)25(36)40-28(7,8)9/h10-19,37H,1-9H3