[2-oxidanylidene-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl] 3-acetamidopropanoate

Systemtic Name: [2-oxidanylidene-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl] 3-acetamidopropanoate Openeye Name: [2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl] 3-acetamidopropanoate CAS Name: 3-acetamidopropanoic acid [2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl] 3-acetamidopropanoate Traditional Name: 3-acetamidopropionic acid [2-keto-2-(3-phenyl-2-pyrazolin-1-yl)ethyl] ester Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC(=O)OCC(=O)N1CCC(=N1)C2=CC=CC=C2

Isomeric SMILES

CC(=O)NCCC(=O)OCC(=O)N1CCC(=N1)C2=CC=CC=C2

InChI

InChI=1S/C16H19N3O4/c1-12(20)17-9-7-16(22)23-11-15(21)19-10-8-14(18-19)13-5-3-2-4-6-13/h2-6H,7-11H2,1H3,(H,17,20)