ethyl 2-acetamido-3-oxidanyl-3-[6-(5-phenylpent-1-ynyl)pyridin-2-yl]propanoate

Systemtic Name: ethyl 2-acetamido-3-oxidanyl-3-[6-(5-phenylpent-1-ynyl)pyridin-2-yl]propanoate Openeye Name: ethyl 2-acetamido-3-hydroxy-3-[6-(5-phenylpent-1-ynyl)-2-pyridyl]propanoate CAS Name: 2-acetamido-3-hydroxy-3-[6-(5-phenylpent-1-ynyl)-2-pyridinyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-acetamido-3-hydroxy-3-[6-(5-phenylpent-1-ynyl)pyridin-2-yl]propanoate Traditional Name: 2-acetamido-3-hydroxy-3-[6-(5-phenylpent-1-ynyl)-2-pyridyl]propionic acid ethyl ester Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=CC(=N1)C#CCCCC2=CC=CC=C2)O)NC(=O)C

Isomeric SMILES

CCOC(=O)C(C(C1=CC=CC(=N1)C#CCCCC2=CC=CC=C2)O)NC(=O)C

InChI

InChI=1S/C23H26N2O4/c1-3-29-23(28)21(24-17(2)26)22(27)20-16-10-15-19(25-20)14-9-5-8-13-18-11-6-4-7-12-18/h4,6-7,10-12,15-16,21-22,27H,3,5,8,13H2,1-2H3,(H,24,26)