2-[1-(2-acetyloxyethyl)-3-ethyl-pyrrol-2-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[1-(2-acetyloxyethyl)-3-ethyl-pyrrol-2-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[1-(2-acetoxyethyl)-3-ethyl-pyrrol-2-yl]-2-oxo-acetic acid CAS Name: 2-[1-(2-acetyloxyethyl)-3-ethyl-2-pyrrolyl]-2-oxoacetic acid IUPAC Name: 2-[1-(2-acetyloxyethyl)-3-ethylpyrrol-2-yl]-2-oxoacetic acid Traditional Name: 2-[1-(2-acetoxyethyl)-3-ethyl-pyrrol-2-yl]-2-keto-acetic acid Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C=C1)CCOC(=O)C)C(=O)C(=O)O

Isomeric SMILES

CCC1=C(N(C=C1)CCOC(=O)C)C(=O)C(=O)O

InChI

InChI=1S/C12H15NO5/c1-3-9-4-5-13(6-7-18-8(2)14)10(9)11(15)12(16)17/h4-5H,3,6-7H2,1-2H3,(H,16,17)