tert-butyl 3-[2-(2,2-dimethylpropanoylamino)-5-oxidanyl-4-phenyl-pyridin-3-yl]propanoate

Systemtic Name: tert-butyl 3-[2-(2,2-dimethylpropanoylamino)-5-oxidanyl-4-phenyl-pyridin-3-yl]propanoate Openeye Name: tert-butyl 3-[2-(2,2-dimethylpropanoylamino)-5-hydroxy-4-phenyl-3-pyridyl]propanoate CAS Name: 3-[2-[(2,2-dimethyl-1-oxopropyl)amino]-5-hydroxy-4-phenyl-3-pyridinyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-(2,2-dimethylpropanoylamino)-5-hydroxy-4-phenylpyridin-3-yl]propanoate Traditional Name: 3-[5-hydroxy-4-phenyl-2-(pivaloylamino)-3-pyridyl]propionic acid tert-butyl ester Formula: C23H30N2O4 MolecularWeight: 398.4953

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=NC=C(C(=C1CCC(=O)OC(C)(C)C)C2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)C(=O)NC1=NC=C(C(=C1CCC(=O)OC(C)(C)C)C2=CC=CC=C2)O

InChI

InChI=1S/C23H30N2O4/c1-22(2,3)21(28)25-20-16(12-13-18(27)29-23(4,5)6)19(17(26)14-24-20)15-10-8-7-9-11-15/h7-11,14,26H,12-13H2,1-6H3,(H,24,25,28)