tert-butyl 2-(2-oxidanyl-1-phenyl-2,2-dipyridin-3-yl-ethyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-(2-oxidanyl-1-phenyl-2,2-dipyridin-3-yl-ethyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[2-hydroxy-1-phenyl-2,2-bis(3-pyridyl)ethyl]pyrrolidine-1-carboxylate CAS Name: 2-[2-hydroxy-1-phenyl-2,2-bis(3-pyridinyl)ethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(2-hydroxy-1-phenyl-2,2-dipyridin-3-ylethyl)pyrrolidine-1-carboxylate Traditional Name: 2-[2-hydroxy-1-phenyl-2,2-bis(3-pyridyl)ethyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C27H31N3O3 MolecularWeight: 445.55334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(C2=CC=CC=C2)C(C3=CN=CC=C3)(C4=CN=CC=C4)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1C(C2=CC=CC=C2)C(C3=CN=CC=C3)(C4=CN=CC=C4)O

InChI

InChI=1S/C27H31N3O3/c1-26(2,3)33-25(31)30-17-9-14-23(30)24(20-10-5-4-6-11-20)27(32,21-12-7-15-28-18-21)22-13-8-16-29-19-22/h4-8,10-13,15-16,18-19,23-24,32H,9,14,17H2,1-3H3