[(4-cyano-2-oxidanyl-phenyl)carbonyl-(2-hydroxyethyl)amino] 3,3-dimethylbutanoate

Systemtic Name: [(4-cyano-2-oxidanyl-phenyl)carbonyl-(2-hydroxyethyl)amino] 3,3-dimethylbutanoate Openeye Name: [(4-cyano-2-hydroxy-benzoyl)-(2-hydroxyethyl)amino] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [[(4-cyano-2-hydroxyphenyl)-oxomethyl]-(2-hydroxyethyl)amino] ester IUPAC Name: [(4-cyano-2-hydroxybenzoyl)-(2-hydroxyethyl)amino] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [(4-cyano-2-hydroxy-benzoyl)-(2-hydroxyethyl)amino] ester Formula: C16H20N2O5 MolecularWeight: 320.3404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)ON(CCO)C(=O)C1=C(C=C(C=C1)C#N)O

Isomeric SMILES

CC(C)(C)CC(=O)ON(CCO)C(=O)C1=C(C=C(C=C1)C#N)O

InChI

InChI=1S/C16H20N2O5/c1-16(2,3)9-14(21)23-18(6-7-19)15(22)12-5-4-11(10-17)8-13(12)20/h4-5,8,19-20H,6-7,9H2,1-3H3