tert-butyl (2R)-2-[(6-chloranyl-5-oct-1-ynyl-pyridin-3-yl)oxymethyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2R)-2-[(6-chloranyl-5-oct-1-ynyl-pyridin-3-yl)oxymethyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2R)-2-[(6-chloro-5-oct-1-ynyl-3-pyridyl)oxymethyl]pyrrolidine-1-carboxylate CAS Name: (2R)-2-[(6-chloro-5-oct-1-ynyl-3-pyridinyl)oxymethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-[(6-chloro-5-oct-1-ynylpyridin-3-yl)oxymethyl]pyrrolidine-1-carboxylate Traditional Name: (2R)-2-[(6-chloro-5-oct-1-ynyl-3-pyridyl)oxymethyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C23H33ClN2O3 MolecularWeight: 420.97272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1=CC(=CN=C1Cl)OCC2CCCN2C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCC#CC1=CC(=CN=C1Cl)OC[C@H]2CCCN2C(=O)OC(C)(C)C

InChI

InChI=1S/C23H33ClN2O3/c1-5-6-7-8-9-10-12-18-15-20(16-25-21(18)24)28-17-19-13-11-14-26(19)22(27)29-23(2,3)4/h15-16,19H,5-9,11,13-14,17H2,1-4H3/t19-/m1/s1