tert-butyl 3-[(4-cyano-2-oxidanyl-phenyl)carbonyl-(2-hydroxyethyl)amino]propanoate

Systemtic Name: tert-butyl 3-[(4-cyano-2-oxidanyl-phenyl)carbonyl-(2-hydroxyethyl)amino]propanoate Openeye Name: tert-butyl 3-[(4-cyano-2-hydroxy-benzoyl)-(2-hydroxyethyl)amino]propanoate CAS Name: 3-[[(4-cyano-2-hydroxyphenyl)-oxomethyl]-(2-hydroxyethyl)amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(4-cyano-2-hydroxybenzoyl)-(2-hydroxyethyl)amino]propanoate Traditional Name: 3-[(4-cyano-2-hydroxy-benzoyl)-(2-hydroxyethyl)amino]propionic acid tert-butyl ester Formula: C17H22N2O5 MolecularWeight: 334.36698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCN(CCO)C(=O)C1=C(C=C(C=C1)C#N)O

Isomeric SMILES

CC(C)(C)OC(=O)CCN(CCO)C(=O)C1=C(C=C(C=C1)C#N)O

InChI

InChI=1S/C17H22N2O5/c1-17(2,3)24-15(22)6-7-19(8-9-20)16(23)13-5-4-12(11-18)10-14(13)21/h4-5,10,20-21H,6-9H2,1-3H3