1-[(Z)-1-ethoxy-1-oxidanyl-3-oxidanylidene-but-1-en-2-yl]-2,5-dimethyl-4-thiophen-2-yl-pyrrole-3-carboxylic acid

Systemtic Name: 1-[(Z)-1-ethoxy-1-oxidanyl-3-oxidanylidene-but-1-en-2-yl]-2,5-dimethyl-4-thiophen-2-yl-pyrrole-3-carboxylic acid Openeye Name: 1-[(1Z)-1-[ethoxy(hydroxy)methylene]-2-oxo-propyl]-2,5-dimethyl-4-(2-thienyl)pyrrole-3-carboxylic acid CAS Name: 1-[(Z)-1-ethoxy-1-hydroxy-3-oxobut-1-en-2-yl]-2,5-dimethyl-4-thiophen-2-yl-3-pyrrolecarboxylic acid IUPAC Name: 1-[(Z)-1-ethoxy-1-hydroxy-3-oxobut-1-en-2-yl]-2,5-dimethyl-4-thiophen-2-ylpyrrole-3-carboxylic acid Traditional Name: 1-[(Z)-1-acetyl-2-ethoxy-2-hydroxy-vinyl]-2,5-dimethyl-4-(2-thienyl)pyrrole-3-carboxylic acid Formula: C17H19NO5S MolecularWeight: 349.40146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)C)N1C(=C(C(=C1C)C(=O)O)C2=CC=CS2)C)O

Isomeric SMILES

CCO/C(=C(/C(=O)C)\N1C(=C(C(=C1C)C(=O)O)C2=CC=CS2)C)/O

InChI

InChI=1S/C17H19NO5S/c1-5-23-17(22)15(11(4)19)18-9(2)13(12-7-6-8-24-12)14(10(18)3)16(20)21/h6-8,22H,5H2,1-4H3,(H,20,21)/b17-15-