ethyl 2-oxidanyl-2-(1,2,5-trimethylpyrrol-3-yl)butanoate

Systemtic Name: ethyl 2-oxidanyl-2-(1,2,5-trimethylpyrrol-3-yl)butanoate Openeye Name: ethyl 2-hydroxy-2-(1,2,5-trimethylpyrrol-3-yl)butanoate CAS Name: 2-hydroxy-2-(1,2,5-trimethyl-3-pyrrolyl)butanoic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-2-(1,2,5-trimethylpyrrol-3-yl)butanoate Traditional Name: 2-hydroxy-2-(1,2,5-trimethylpyrrol-3-yl)butyric acid ethyl ester Formula: C13H21NO3 MolecularWeight: 239.31074

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(N(C(=C1)C)C)C)(C(=O)OCC)O

Isomeric SMILES

CCC(C1=C(N(C(=C1)C)C)C)(C(=O)OCC)O

InChI

InChI=1S/C13H21NO3/c1-6-13(16,12(15)17-7-2)11-8-9(3)14(5)10(11)4/h8,16H,6-7H2,1-5H3