tert-butyl 2-[(E)-2-[5-(4-oxidanylphenoxy)pyridin-3-yl]ethenyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[(E)-2-[5-(4-oxidanylphenoxy)pyridin-3-yl]ethenyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[(E)-2-[5-(4-hydroxyphenoxy)-3-pyridyl]vinyl]pyrrolidine-1-carboxylate CAS Name: 2-[(E)-2-[5-(4-hydroxyphenoxy)-3-pyridinyl]ethenyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(E)-2-[5-(4-hydroxyphenoxy)pyridin-3-yl]ethenyl]pyrrolidine-1-carboxylate Traditional Name: 2-[(E)-2-[5-(4-hydroxyphenoxy)-3-pyridyl]vinyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C=CC2=CC(=CN=C2)OC3=CC=C(C=C3)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1/C=C/C2=CC(=CN=C2)OC3=CC=C(C=C3)O

InChI

InChI=1S/C22H26N2O4/c1-22(2,3)28-21(26)24-12-4-5-17(24)7-6-16-13-20(15-23-14-16)27-19-10-8-18(25)9-11-19/h6-11,13-15,17,25H,4-5,12H2,1-3H3/b7-6+