4-(4-ethoxy-4-oxidanylidene-butanoyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-(4-ethoxy-4-oxidanylidene-butanoyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Openeye Name: 4-(4-ethoxy-4-oxo-butanoyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid CAS Name: 4-(4-ethoxy-1,4-dioxobutyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-(4-ethoxy-4-oxobutanoyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Traditional Name: 4-(4-ethoxy-4-keto-butanoyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Formula: C13H17NO5 MolecularWeight: 267.27778

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)C1=C(NC(=C1C)C(=O)O)C

Isomeric SMILES

CCOC(=O)CCC(=O)C1=C(NC(=C1C)C(=O)O)C

InChI

InChI=1S/C13H17NO5/c1-4-19-10(16)6-5-9(15)11-7(2)12(13(17)18)14-8(11)3/h14H,4-6H2,1-3H3,(H,17,18)