tert-butyl 3-(4-cyano-2-oxidanyl-phenoxy)-2-oxidanylidene-3-pyrrolidin-1-yl-propanoate

Systemtic Name: tert-butyl 3-(4-cyano-2-oxidanyl-phenoxy)-2-oxidanylidene-3-pyrrolidin-1-yl-propanoate Openeye Name: tert-butyl 3-(4-cyano-2-hydroxy-phenoxy)-2-oxo-3-pyrrolidin-1-yl-propanoate CAS Name: 3-(4-cyano-2-hydroxyphenoxy)-2-oxo-3-(1-pyrrolidinyl)propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(4-cyano-2-hydroxyphenoxy)-2-oxo-3-pyrrolidin-1-ylpropanoate Traditional Name: 3-(4-cyano-2-hydroxy-phenoxy)-2-keto-3-pyrrolidino-propionic acid tert-butyl ester Formula: C18H22N2O5 MolecularWeight: 346.37768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(=O)C(N1CCCC1)OC2=C(C=C(C=C2)C#N)O

Isomeric SMILES

CC(C)(C)OC(=O)C(=O)C(N1CCCC1)OC2=C(C=C(C=C2)C#N)O

InChI

InChI=1S/C18H22N2O5/c1-18(2,3)25-17(23)15(22)16(20-8-4-5-9-20)24-14-7-6-12(11-19)10-13(14)21/h6-7,10,16,21H,4-5,8-9H2,1-3H3