5-ethyl-1-[(Z)-1-methoxy-1-oxidanyl-3-oxidanylidene-but-1-en-2-yl]-2-methyl-4-thiophen-2-yl-pyrrole-3-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1C(=C(O)OC)C(=O)C)C)C(=O)O)C2=CC=CS2

Isomeric SMILES

CCC1=C(C(=C(N1/C(=C(/O)\OC)/C(=O)C)C)C(=O)O)C2=CC=CS2

InChI

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