tert-butyl 3-[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]oxirane-2-carboxylate

Systemtic Name: tert-butyl 3-[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]oxirane-2-carboxylate Openeye Name: tert-butyl 3-[4-[2-(5-ethyl-2-pyridyl)ethoxy]phenyl]oxirane-2-carboxylate CAS Name: 3-[4-[2-(5-ethyl-2-pyridinyl)ethoxy]phenyl]-2-oxiranecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]oxirane-2-carboxylate Traditional Name: 3-[4-[2-(5-ethyl-2-pyridyl)ethoxy]phenyl]oxirane-2-carboxylic acid tert-butyl ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)CCOC2=CC=C(C=C2)C3C(O3)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=CN=C(C=C1)CCOC2=CC=C(C=C2)C3C(O3)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H27NO4/c1-5-15-6-9-17(23-14-15)12-13-25-18-10-7-16(8-11-18)19-20(26-19)21(24)27-22(2,3)4/h6-11,14,19-20H,5,12-13H2,1-4H3