tert-butyl (2S)-2-[[5-(2-pyridin-4-ylethyl)pyridin-3-yl]oxymethyl]azetidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[[5-(2-pyridin-4-ylethyl)pyridin-3-yl]oxymethyl]azetidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[[5-[2-(4-pyridyl)ethyl]-3-pyridyl]oxymethyl]azetidine-1-carboxylate CAS Name: (2S)-2-[[5-(2-pyridin-4-ylethyl)-3-pyridinyl]oxymethyl]-1-azetidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[5-(2-pyridin-4-ylethyl)pyridin-3-yl]oxymethyl]azetidine-1-carboxylate Traditional Name: (2S)-2-[[5-[2-(4-pyridyl)ethyl]-3-pyridyl]oxymethyl]azetidine-1-carboxylic acid tert-butyl ester Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC1COC2=CN=CC(=C2)CCC3=CC=NC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[C@H]1COC2=CN=CC(=C2)CCC3=CC=NC=C3

InChI

InChI=1S/C21H27N3O3/c1-21(2,3)27-20(25)24-11-8-18(24)15-26-19-12-17(13-23-14-19)5-4-16-6-9-22-10-7-16/h6-7,9-10,12-14,18H,4-5,8,11,15H2,1-3H3/t18-/m0/s1